bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline

C117H126EuF6N18O2Os2P4+4 — CID 161009864

About bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline

bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline (PubChem CID 161009864) has the molecular formula C117H126EuF6N18O2Os2P4+4 and a molecular weight of 2586.73 g/mol. Its IUPAC name is bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline.

Molecular Properties

• Compound Name: bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline
• PubChem CID: 161009864
• Molecular Formula: C117H126EuF6N18O2Os2P4+4
• Molecular Weight: 2586.73 g/mol
• Exact Mass: 2589.76
• IUPAC Name: bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline
• SMILES: CC(C)(C)c1ccnc(-c2nc(C(F)(F)F)n[n-]2)c1.CC(C)(C)c1ccnc(-c2nc(C(F)(F)F)n[n-]2)c1.C[PH+](C)c1ccccc1.C[PH+](C)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.Cc1n[n-]c(-c2cc(C(C)(C)C)ccn2)n1.Cc1n[n-]c(-c2cc(C(C)(C)C)ccn2)n1.O=C(C=C(O)c1ccccc1)c1ccccc1.[Eu].[Os+2].[Os+2].c1cnc2c(c1)ccc1cccnc12
• InChI: InChI=1S/C15H12O2.2C13H13P.2C12H12F3N4.2C12H15N4.C12H8N2.2C8H11P.Eu.2Os/c16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;2*1-11(2,3)7-4-5-16-8(6-7)9-17-10(19-18-9)12(13,14)15;2*1-8-14-11(16-15-8)10-7-9(5-6-13-10)12(2,3)4;1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;2*1-9(2)8-6-4-3-5-7-8;;;/h1-11,16H;2*2-11H,1H3;2*4-6H,1-3H3;2*5-7H,1-4H3;1-8H;2*3-7H,1-2H3;;;/q;;;4*-1;;;;;2*+2/p+4
• InChIKey: DSJJKXWYQQCNFE-UHFFFAOYSA-R
• XLogP: 24.61
• TPSA: 274.16 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 16
• Rotatable Bonds: 13
• Heavy Atoms: 150
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2586.73
LogP ≤ 5	24.61
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline?

The IUPAC name of bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline (CID 161009864) is bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline.

What is the SMILES notation for bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline?

The canonical SMILES for bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline is CC(C)(C)c1ccnc(-c2nc(C(F)(F)F)n[n-]2)c1.CC(C)(C)c1ccnc(-c2nc(C(F)(F)F)n[n-]2)c1.C[PH+](C)c1ccccc1.C[PH+](C)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.Cc1n[n-]c(-c2cc(C(C)(C)C)ccn2)n1.Cc1n[n-]c(-c2cc(C(C)(C)C)ccn2)n1.O=C(C=C(O)c1ccccc1)c1ccccc1.[Eu].[Os+2].[Os+2].c1cnc2c(c1)ccc1cccnc12.

What is the InChIKey of bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline?

The InChIKey is DSJJKXWYQQCNFE-UHFFFAOYSA-R. The full InChI is InChI=1S/C15H12O2.2C13H13P.2C12H12F3N4.2C12H15N4.C12H8N2.2C8H11P.Eu.2Os/c16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;2*1-11(2,3)7-4-5-16-8(6-7)9-17-10(19-18-9)12(13,14)15;2*1-8-14-11(16-15-8)10-7-9(5-6-13-10)12(2,3)4;1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;2*1-9(2)8-6-4-3-5-7-8;;;/h1-11,16H;2*2-11H,1H3;2*4-6H,1-3H3;2*5-7H,1-4H3;1-8H;2*3-7H,1-2H3;;;/q;;;4*-1;;;;;2*+2/p+4.

What are the key properties of bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline?

bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline has a molecular weight of 2586.73 g/mol, XLogP of 24.61, 13 rotatable bonds, 1 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for bis(4-tert-butyl-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(4-tert-butyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(dimethyl(phenyl)phosphanium);europium;3-hydroxy-1,3-diphenylprop-2-en-1-one;bis(methyl(diphenyl)phosphanium);bis(osmium(2+));1,10-phenanthroline is sourced from PubChem (CID 161009864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).