carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium)

C189H244Cr7N14P7+7 — CID 159971299

IUPACcarbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium)
SMILESCc1cc(C)c(/N=C(/N[PH+](C(C)C)C(C)C)c2ccccc2)c(C)c1.Cc1cc(C)c(/N=C(/N[PH+](C(C)C)C(C)C)c2ccccc2)c(C)c1.Cc1cc(C)c(/N=C(/N[PH+](c2ccccc2)c2ccccc2)c2ccccc2)c(C)c1.Cc1cc(C)c(/N=C(/N[PH+](c2ccccc2)c2ccccc2)c2ccccc2)c(C)c1.Cc1cccc(C)c1/N=C(/N[PH+](C(C)C)C(C)C)c1ccccc1.Cc1cccc(C)c1/N=C(/N[PH+](c1ccccc1)c1ccccc1)c1ccccc1.Cc1cccc(C)c1/N=C(/N[PH+](c1ccccc1)c1ccccc1)c1ccccc1.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Cr+2].[Cr+2].[Cr+2].[Cr+2].[Cr+2].[Cr+2].[Cr+2]
InChIInChI=1S/2C28H27N2P.2C27H25N2P.2C22H31N2P.C21H29N2P.14CH3.7Cr/c2*1-21-19-22(2)27(23(3)20-21)29-28(24-13-7-4-8-14-24)30-31(25-15-9-5-10-16-25)26-17-11-6-12-18-26;2*1-21-13-12-14-22(2)26(21)28-27(23-15-6-3-7-16-23)29-30(24-17-8-4-9-18-24)25-19-10-5-11-20-25;2*1-15(2)25(16(3)4)24-22(20-11-9-8-10-12-20)23-21-18(6)13-17(5)14-19(21)7;1-15(2)24(16(3)4)23-21(19-13-8-7-9-14-19)22-20-17(5)11-10-12-18(20)6;;;;;;;;;;;;;;;;;;;;;/h2*4-20H,1-3H3,(H,29,30);2*3-20H,1-2H3,(H,28,29);2*8-16H,1-7H3,(H,23,24);7-16H,1-6H3,(H,22,23);14*1H3;;;;;;;/q;;;;;;;14*-1;7*+2/p+7
InChIKeyZBTZQTVCMVHTSK-UHFFFAOYSA-U
MW3292.92 g/mol
LogP48.28
Rot. Bonds35

About carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium)

carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium) (PubChem CID 159971299) has the molecular formula C189H244Cr7N14P7+7 and a molecular weight of 3292.92 g/mol. Its IUPAC name is carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium).

Molecular Properties

Compound Namecarbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium)
PubChem CID159971299
Molecular FormulaC189H244Cr7N14P7+7
Molecular Weight3292.92 g/mol
Exact Mass3290.35
IUPAC Namecarbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium)
SMILESCc1cc(C)c(/N=C(/N[PH+](C(C)C)C(C)C)c2ccccc2)c(C)c1.Cc1cc(C)c(/N=C(/N[PH+](C(C)C)C(C)C)c2ccccc2)c(C)c1.Cc1cc(C)c(/N=C(/N[PH+](c2ccccc2)c2ccccc2)c2ccccc2)c(C)c1.Cc1cc(C)c(/N=C(/N[PH+](c2ccccc2)c2ccccc2)c2ccccc2)c(C)c1.Cc1cccc(C)c1/N=C(/N[PH+](C(C)C)C(C)C)c1ccccc1.Cc1cccc(C)c1/N=C(/N[PH+](c1ccccc1)c1ccccc1)c1ccccc1.Cc1cccc(C)c1/N=C(/N[PH+](c1ccccc1)c1ccccc1)c1ccccc1.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Cr+2].[Cr+2].[Cr+2].[Cr+2].[Cr+2].[Cr+2].[Cr+2]
InChIInChI=1S/2C28H27N2P.2C27H25N2P.2C22H31N2P.C21H29N2P.14CH3.7Cr/c2*1-21-19-22(2)27(23(3)20-21)29-28(24-13-7-4-8-14-24)30-31(25-15-9-5-10-16-25)26-17-11-6-12-18-26;2*1-21-13-12-14-22(2)26(21)28-27(23-15-6-3-7-16-23)29-30(24-17-8-4-9-18-24)25-19-10-5-11-20-25;2*1-15(2)25(16(3)4)24-22(20-11-9-8-10-12-20)23-21-18(6)13-17(5)14-19(21)7;1-15(2)24(16(3)4)23-21(19-13-8-7-9-14-19)22-20-17(5)11-10-12-18(20)6;;;;;;;;;;;;;;;;;;;;;/h2*4-20H,1-3H3,(H,29,30);2*3-20H,1-2H3,(H,28,29);2*8-16H,1-7H3,(H,23,24);7-16H,1-6H3,(H,22,23);14*1H3;;;;;;;/q;;;;;;;14*-1;7*+2/p+7
InChIKeyZBTZQTVCMVHTSK-UHFFFAOYSA-U
XLogP48.28
TPSA170.73 Ų
H-Bond Donors7
H-Bond Acceptors7
Rotatable Bonds35
Heavy Atoms217
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003292.92
LogP ≤ 548.28
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 107

Analyze carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium) with MolForge

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Frequently Asked Questions

What is the IUPAC name of carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium)?
The IUPAC name of carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium) (CID 159971299) is carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium).
What is the SMILES notation for carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium)?
The canonical SMILES for carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium) is Cc1cc(C)c(/N=C(/N[PH+](C(C)C)C(C)C)c2ccccc2)c(C)c1.Cc1cc(C)c(/N=C(/N[PH+](C(C)C)C(C)C)c2ccccc2)c(C)c1.Cc1cc(C)c(/N=C(/N[PH+](c2ccccc2)c2ccccc2)c2ccccc2)c(C)c1.Cc1cc(C)c(/N=C(/N[PH+](c2ccccc2)c2ccccc2)c2ccccc2)c(C)c1.Cc1cccc(C)c1/N=C(/N[PH+](C(C)C)C(C)C)c1ccccc1.Cc1cccc(C)c1/N=C(/N[PH+](c1ccccc1)c1ccccc1)c1ccccc1.Cc1cccc(C)c1/N=C(/N[PH+](c1ccccc1)c1ccccc1)c1ccccc1.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Cr+2].[Cr+2].[Cr+2].[Cr+2].[Cr+2].[Cr+2].[Cr+2].
What is the InChIKey of carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium)?
The InChIKey is ZBTZQTVCMVHTSK-UHFFFAOYSA-U. The full InChI is InChI=1S/2C28H27N2P.2C27H25N2P.2C22H31N2P.C21H29N2P.14CH3.7Cr/c2*1-21-19-22(2)27(23(3)20-21)29-28(24-13-7-4-8-14-24)30-31(25-15-9-5-10-16-25)26-17-11-6-12-18-26;2*1-21-13-12-14-22(2)26(21)28-27(23-15-6-3-7-16-23)29-30(24-17-8-4-9-18-24)25-19-10-5-11-20-25;2*1-15(2)25(16(3)4)24-22(20-11-9-8-10-12-20)23-21-18(6)13-17(5)14-19(21)7;1-15(2)24(16(3)4)23-21(19-13-8-7-9-14-19)22-20-17(5)11-10-12-18(20)6;;;;;;;;;;;;;;;;;;;;;/h2*4-20H,1-3H3,(H,29,30);2*3-20H,1-2H3,(H,28,29);2*8-16H,1-7H3,(H,23,24);7-16H,1-6H3,(H,22,23);14*1H3;;;;;;;/q;;;;;;;14*-1;7*+2/p+7.
What are the key properties of carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium)?
carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium) has a molecular weight of 3292.92 g/mol, XLogP of 48.28, 35 rotatable bonds, 7 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;heptakis(chromium(2+));bis([[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-diphenylphosphanium);[[N-(2,6-dimethylphenyl)-C-phenylcarbonimidoyl]amino]-di(propan-2-yl)phosphanium;bis(diphenyl-[[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]phosphanium);bis([[C-phenyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]amino]-di(propan-2-yl)phosphanium) is sourced from PubChem (CID 159971299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).