dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate

C150H151Cl4IrN13O12Os2P3PtReRuTb-2 — CID 159784543

IUPACdichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate
SMILESC.C.CC(O)CC(C)O.CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC.Cl[Re]Cl.P.[CH-]=O.[CH-]=O.[Ir+3].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[Os].[Os].[Pt+2].[Ru].[Tb].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1cnc2c(c1)ccc1cccnc12
InChIInChI=1S/C36H44N4.C26H24P2.C24H16N2.C12H8N2.3C11H8N.C10H8N2.C5H12O2.2CHO.2CH4.2ClHO4.2ClH.Ir.2Os.H3P.Pt.Re.Ru.Tb/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18;1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;3*1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-4(6)3-5(2)7;2*1-2;;;2*2-1(3,4)5;;;;;;;;;;/h17-20H,9-16H2,1-8H3;1-20H,21-22H2;1-16H;1-8H;3*1-6,8-9H;1-8H;4-7H,3H2,1-2H3;2*1H;2*1H4;2*(H,2,3,4,5);2*1H;;;;1H3;;;;/q-2;;;;3*-1;;;2*-1;;;;;;;+3;;;;2*+2;;/p-2/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyLKPBSUDMKXMIFA-KHGPSUTCSA-L
MW3776.63 g/mol
LogP25.46
Rot. Bonds23

About dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate

dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate (PubChem CID 159784543) has the molecular formula C150H151Cl4IrN13O12Os2P3PtReRuTb-2 and a molecular weight of 3776.63 g/mol. Its IUPAC name is dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate.

Molecular Properties

Compound Namedichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate
PubChem CID159784543
Molecular FormulaC150H151Cl4IrN13O12Os2P3PtReRuTb-2
Molecular Weight3776.63 g/mol
Exact Mass3778.59
IUPAC Namedichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate
SMILESC.C.CC(O)CC(C)O.CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC.Cl[Re]Cl.P.[CH-]=O.[CH-]=O.[Ir+3].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[Os].[Os].[Pt+2].[Ru].[Tb].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1cnc2c(c1)ccc1cccnc12
InChIInChI=1S/C36H44N4.C26H24P2.C24H16N2.C12H8N2.3C11H8N.C10H8N2.C5H12O2.2CHO.2CH4.2ClHO4.2ClH.Ir.2Os.H3P.Pt.Re.Ru.Tb/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18;1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;3*1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-4(6)3-5(2)7;2*1-2;;;2*2-1(3,4)5;;;;;;;;;;/h17-20H,9-16H2,1-8H3;1-20H,21-22H2;1-16H;1-8H;3*1-6,8-9H;1-8H;4-7H,3H2,1-2H3;2*1H;2*1H4;2*(H,2,3,4,5);2*1H;;;;1H3;;;;/q-2;;;;3*-1;;;2*-1;;;;;;;+3;;;;2*+2;;/p-2/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyLKPBSUDMKXMIFA-KHGPSUTCSA-L
XLogP25.46
TPSA429.07 Ų
H-Bond Donors2
H-Bond Acceptors23
Rotatable Bonds23
Heavy Atoms189
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003776.63
LogP ≤ 525.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate with MolForge

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Related Compounds

bis(10H-benzo[h]quinolin-10-ide);bis(pentane-2,4-diol);bis(2-phenylpyridine);platinum;bis(pyridine-2-carboxylic acid)
CID 159338664
2-(2,4-difluorobenzene-6-id-1-yl)pyridine;4-hydroxypent-3-en-2-one;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;bis(2-phenylpyridine);platinum(2+);pyridine-2-carboxylic acid
CID 159114327
iridium;pentane-2,4-diol;bis(4-phenyl-2-phenylpyridine)
CID 153309687
bis(3-(1,3-benzothiazol-2-yl)-4H-chromen-4-id-2-one);bis(4,7-diphenyl-1,10-phenanthroline);bis(iridium(3+));1,10-phenanthroline;tetrakis(2-phenylpyridine);rhodium(3+)
CID 162022968
carbanide;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;4,7-diphenyl-10H-benzo[h]quinolin-10-ide;2-(2-fluoro-4-methylbenzene-6-id-1-yl)pyridine;bis(iridium);iridium(3+);3-methyl-12H-phenanthro[9,10-b]pyrazin-12-ide;osmium;pentane-2,4-diol;tris(2-phenylpyridine);pyridine-2-carboxylic acid;bis(triphenylphosphanium);cyanide
CID 160701351
iridium;2-methyl-3-phenyl-6-phenylpyridine;phenylbenzene;2-phenylpyridine
CID 166495302
iridium;5-(4-methylphenyl)-8-(2-phenyl-5-pyridin-2-ylbenzene-4-id-1-yl)quinoline;4-methyl-2-phenylpyridine
CID 171751522
2-(3H-1-benzothiophen-3-id-2-yl)pyridine;bis(4-hydroxypent-3-en-2-one);tris(iridium);bis(methyl(diphenyl)phosphanium);4-methyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);2-phenyl-3H-1-benzothiophen-3-ide;2-phenyl-3-phenylquinoxaline;2-phenylpyridine;platinum;platinum(2+);2-pyridin-2-ylpyridine;ruthenium(1+);2-(3H-thiophen-3-id-2-yl)pyridine
CID 158461205
4-butan-2-ylbenzenesulfonic acid;5,7-dimethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;iridium;bis(iridium(3+));3-methyl-2-(3-phenylbenzene-6-id-1-yl)quinoline;pentane-2,4-diol;2-(3-phenylbenzene-6-id-1-yl)pyridine;pentakis(2-phenylpyridine)
CID 161230017
4-tert-butyl-6-(2-methyl-4H-pyridin-4-id-3-yl)pyrimidine;4,7-diphenyl-1,10-phenanthroline;bis(iridium);2-phenylpyridine
CID 158052506
2-(2,4-difluoro-6-methanidylphenyl)-1-methanidylpyridin-1-ium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);2,3,7,8,12,13-hexaethyl-17,18-diethynylporphyrin-22,24-diide;4-hydroxypent-3-en-2-one;iridium(3+);methanidyl-[2-[methanidyl(diphenyl)phosphaniumyl]ethenyl]-diphenylphosphanium;1-methanidyl-2-(2-methanidylphenyl)pyridin-1-ium;1-methanidyl-2-(1-methanidyl-4-phenylpyridin-1-ium-2-yl)-4-phenylpyridin-1-ium;2-(2-methanidylphenyl)pyridine;molecular hydrogen;osmium(4+);bis(2-phenylpyridine);tris(platinum(2+))
CID 162091159
iridium;5-(4-methylphenyl)-8-(2-phenyl-3-pyridin-2-ylbenzene-4-id-1-yl)quinoline;4-methyl-2-phenylpyridine
CID 171751551

Frequently Asked Questions

What is the IUPAC name of dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate?
The IUPAC name of dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate (CID 159784543) is dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate.
What is the SMILES notation for dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate?
The canonical SMILES for dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate is C.C.CC(O)CC(C)O.CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC.Cl[Re]Cl.P.[CH-]=O.[CH-]=O.[Ir+3].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[Os].[Os].[Pt+2].[Ru].[Tb].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1cnc2c(c1)ccc1cccnc12.
What is the InChIKey of dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate?
The InChIKey is LKPBSUDMKXMIFA-KHGPSUTCSA-L. The full InChI is InChI=1S/C36H44N4.C26H24P2.C24H16N2.C12H8N2.3C11H8N.C10H8N2.C5H12O2.2CHO.2CH4.2ClHO4.2ClH.Ir.2Os.H3P.Pt.Re.Ru.Tb/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18;1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;3*1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-4(6)3-5(2)7;2*1-2;;;2*2-1(3,4)5;;;;;;;;;;/h17-20H,9-16H2,1-8H3;1-20H,21-22H2;1-16H;1-8H;3*1-6,8-9H;1-8H;4-7H,3H2,1-2H3;2*1H;2*1H4;2*(H,2,3,4,5);2*1H;;;;1H3;;;;/q-2;;;;3*-1;;;2*-1;;;;;;;+3;;;;2*+2;;/p-2/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;;;;;;;;;;;;;;;;;;;;;;;.
What are the key properties of dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate?
dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate has a molecular weight of 3776.63 g/mol, XLogP of 25.46, 23 rotatable bonds, 2 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for dichlororhenium;4,7-diphenyl-1,10-phenanthroline;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;iridium(3+);methane;methanone;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;pentane-2,4-diol;1,10-phenanthroline;tris(2-phenylpyridine);phosphane;platinum(2+);2-pyridin-2-ylpyridine;ruthenium;terbium;diperchlorate is sourced from PubChem (CID 159784543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).