bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum

C34H30N8Pt2-6 — CID 172514234

IUPACbis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum
SMILESCN1[CH-]N(c2[c-]cccc2)c2ccccc21.CN1[CH-]N(c2[c-]cccc2)c2ccccc21.[Pt].[Pt].[c-]1ncc[nH]1.[c-]1ncc[nH]1
InChIInChI=1S/2C14H12N2.2C3H3N2.2Pt/c2*1-15-11-16(12-7-3-2-4-8-12)14-10-6-5-9-13(14)15;2*1-2-5-3-4-1;;/h2*2-7,9-11H,1H3;2*1-2H,(H,4,5);;/q2*-2;2*-1;;
InChIKeyYRXPUJCCQJRNJG-UHFFFAOYSA-N
MW940.83 g/mol
LogP6.80
Rot. Bonds2

About bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum

bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum (PubChem CID 172514234) has the molecular formula C34H30N8Pt2-6 and a molecular weight of 940.83 g/mol. Its IUPAC name is bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum.

Molecular Properties

Compound Namebis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum
PubChem CID172514234
Molecular FormulaC34H30N8Pt2-6
Molecular Weight940.83 g/mol
Exact Mass940.19
IUPAC Namebis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum
SMILESCN1[CH-]N(c2[c-]cccc2)c2ccccc21.CN1[CH-]N(c2[c-]cccc2)c2ccccc21.[Pt].[Pt].[c-]1ncc[nH]1.[c-]1ncc[nH]1
InChIInChI=1S/2C14H12N2.2C3H3N2.2Pt/c2*1-15-11-16(12-7-3-2-4-8-12)14-10-6-5-9-13(14)15;2*1-2-5-3-4-1;;/h2*2-7,9-11H,1H3;2*1-2H,(H,4,5);;/q2*-2;2*-1;;
InChIKeyYRXPUJCCQJRNJG-UHFFFAOYSA-N
XLogP6.80
TPSA70.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500940.83
LogP ≤ 56.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

lawrencium;1-methyl-3-phenyl-2H-benzimidazol-2-ide
CID 170209546
bis(1,4-dimethyl-2H-imidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum
CID 172514289
iridium;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide
CID 58556265
iridium;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-phenyl-3-[4-(3-phenyl-2H-benzimidazol-2-id-1-yl)butyl]-2H-benzimidazol-2-ide
CID 155625565
osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium)
CID 147264576
3-cyclohepta-1,3,5-trien-1-yl-1-methyl-2,6-dihydrocyclohepta[d]imidazol-2-ide;bis(1,3-dihydropyrazol-3-ide);1-methyl-3-phenyl-2H-benzimidazol-2-ide;platinum
CID 172514229
chlorocopper;1-methyl-3-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]-2H-benzimidazol-2-ide
CID 58544736
4-(2,6-dimethylphenyl)-3-(2-methylphenyl)-5-phenyl-1,2,4-triazole;iridium(3+);1-methyl-3-phenyl-2H-benzimidazol-2-ide
CID 140736391
1,4-diphenyl-2H-imidazol-2-ide;1-methyl-3-phenyl-2H-benzimidazol-2-ide;4-methyl-1-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;platinum
CID 172514248
1,4,4,5,5,6,6-heptamethyl-3-phenyl-2H-cyclopenta[d]imidazol-2-ide;iridium
CID 140677085
bis(10H-benzo[h]quinolin-10-ide);tetrakis(iridium);methane;octakis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);bis(1-phenylisoquinoline)
CID 161395036
CID 140637817
CID 140637817

Frequently Asked Questions

What is the IUPAC name of bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum?
The IUPAC name of bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum (CID 172514234) is bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum.
What is the SMILES notation for bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum?
The canonical SMILES for bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum is CN1[CH-]N(c2[c-]cccc2)c2ccccc21.CN1[CH-]N(c2[c-]cccc2)c2ccccc21.[Pt].[Pt].[c-]1ncc[nH]1.[c-]1ncc[nH]1.
What is the InChIKey of bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum?
The InChIKey is YRXPUJCCQJRNJG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H12N2.2C3H3N2.2Pt/c2*1-15-11-16(12-7-3-2-4-8-12)14-10-6-5-9-13(14)15;2*1-2-5-3-4-1;;/h2*2-7,9-11H,1H3;2*1-2H,(H,4,5);;/q2*-2;2*-1;;.
What are the key properties of bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum?
bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum has a molecular weight of 940.83 g/mol, XLogP of 6.80, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum is sourced from PubChem (CID 172514234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).