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Trans-(carbonyl)(carboxylato)bis(triphenylphosphine)rhodium(I)

Catalog Number ACM32354328
CAS 32354-32-8
Synonyms Carbon monoxide;rhodium;triphenylphosphanium;formate
Molecular Weight 702.5
Molecular Formula C38H33O3P2Rh
Canonical SMILES [C-]#[O+].C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C(=O)[O-].[Rh]
InChI InChI=1S/2C18H15P.CH2O2.CO.Rh/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2-1-3;1-2;/h2*1-15H;1H,(H,2,3);/p+1
InChI Key HZSNXZYZDSSMNH-UHFFFAOYSA-O
Purity 98%
Complexity 572
Covalently-Bonded Unit Count 5
Defined Atom Stereocenter Count 0
Exact Mass 702.09599
Heavy Atom Count 44
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
Monoisotopic Mass 702.09599
Rotatable Bond Count 7
Topological Polar Surface Area 41.1 Ų

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