1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium)

C88H68N7ORh4S-3 — CID 160773595

IUPAC1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium)
SMILESCc1nc(-c2[c-]cccc2)n(C)c1-c1ccc(-c2ccccc2)cc1.Cc1nc(-c2[c-]cccc2)oc1-c1ccc(-c2ccccc2)cc1.Cc1nc(-c2[c-]cccc2)sc1-c1ccc(-c2ccccc2)cc1.Cn1c(-c2ccc(-c3ccccc3)cc2)cn[n+]1-c1[c-]cccc1.[Rh].[Rh].[Rh].[Rh]
InChIInChI=1S/C23H19N2.C22H16NO.C22H16NS.C21H17N3.4Rh/c1-17-22(25(2)23(24-17)21-11-7-4-8-12-21)20-15-13-19(14-16-20)18-9-5-3-6-10-18;2*1-16-21(24-22(23-16)20-10-6-3-7-11-20)19-14-12-18(13-15-19)17-8-4-2-5-9-17;1-23-21(16-22-24(23)20-10-6-3-7-11-20)19-14-12-18(13-15-19)17-8-4-2-5-9-17;;;;/h3-11,13-16H,1-2H3;2*2-10,12-15H,1H3;2-10,12-16H,1H3;;;;/q3*-1;;;;;
InChIKeyLUNAQQBLRBYJJI-UHFFFAOYSA-N
MW1683.25 g/mol
LogP21.39
Rot. Bonds12

About 1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium)

1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium) (PubChem CID 160773595) has the molecular formula C88H68N7ORh4S-3 and a molecular weight of 1683.25 g/mol. Its IUPAC name is 1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium).

Molecular Properties

Compound Name1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium)
PubChem CID160773595
Molecular FormulaC88H68N7ORh4S-3
Molecular Weight1683.25 g/mol
Exact Mass1682.14
IUPAC Name1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium)
SMILESCc1nc(-c2[c-]cccc2)n(C)c1-c1ccc(-c2ccccc2)cc1.Cc1nc(-c2[c-]cccc2)oc1-c1ccc(-c2ccccc2)cc1.Cc1nc(-c2[c-]cccc2)sc1-c1ccc(-c2ccccc2)cc1.Cn1c(-c2ccc(-c3ccccc3)cc2)cn[n+]1-c1[c-]cccc1.[Rh].[Rh].[Rh].[Rh]
InChIInChI=1S/C23H19N2.C22H16NO.C22H16NS.C21H17N3.4Rh/c1-17-22(25(2)23(24-17)21-11-7-4-8-12-21)20-15-13-19(14-16-20)18-9-5-3-6-10-18;2*1-16-21(24-22(23-16)20-10-6-3-7-11-20)19-14-12-18(13-15-19)17-8-4-2-5-9-17;1-23-21(16-22-24(23)20-10-6-3-7-11-20)19-14-12-18(13-15-19)17-8-4-2-5-9-17;;;;/h3-11,13-16H,1-2H3;2*2-10,12-15H,1H3;2-10,12-16H,1H3;;;;/q3*-1;;;;;
InChIKeyLUNAQQBLRBYJJI-UHFFFAOYSA-N
XLogP21.39
TPSA78.44 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms101
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001683.25
LogP ≤ 521.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium)?
The IUPAC name of 1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium) (CID 160773595) is 1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium).
What is the SMILES notation for 1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium)?
The canonical SMILES for 1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium) is Cc1nc(-c2[c-]cccc2)n(C)c1-c1ccc(-c2ccccc2)cc1.Cc1nc(-c2[c-]cccc2)oc1-c1ccc(-c2ccccc2)cc1.Cc1nc(-c2[c-]cccc2)sc1-c1ccc(-c2ccccc2)cc1.Cn1c(-c2ccc(-c3ccccc3)cc2)cn[n+]1-c1[c-]cccc1.[Rh].[Rh].[Rh].[Rh].
What is the InChIKey of 1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium)?
The InChIKey is LUNAQQBLRBYJJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N2.C22H16NO.C22H16NS.C21H17N3.4Rh/c1-17-22(25(2)23(24-17)21-11-7-4-8-12-21)20-15-13-19(14-16-20)18-9-5-3-6-10-18;2*1-16-21(24-22(23-16)20-10-6-3-7-11-20)19-14-12-18(13-15-19)17-8-4-2-5-9-17;1-23-21(16-22-24(23)20-10-6-3-7-11-20)19-14-12-18(13-15-19)17-8-4-2-5-9-17;;;;/h3-11,13-16H,1-2H3;2*2-10,12-15H,1H3;2-10,12-16H,1H3;;;;/q3*-1;;;;;.
What are the key properties of 1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium)?
1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium) has a molecular weight of 1683.25 g/mol, XLogP of 21.39, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;1-methyl-2-phenyl-5-(4-phenylphenyl)triazol-2-ium;tetrakis(rhodium) is sourced from PubChem (CID 160773595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).