(Z)-3-nitroso-N-oxidanidyl-but-2-en-2-amine; propan-1-ol; rhodium(2+); triphenylphosphane

Systemtic Name: (Z)-3-nitroso-N-oxidanidyl-but-2-en-2-amine; propan-1-ol; rhodium(2+); triphenylphosphane Openeye Name: (Z)-3-nitroso-N-oxido-but-2-en-2-amine; propan-1-ol; rhodium(2+); triphenylphosphane CAS Name: (Z)-3-nitroso-N-oxido-2-buten-2-amine; 1-propanol; rhodium(2+); triphenylphosphine IUPAC Name: (Z)-3-nitroso-N-oxidobut-2-en-2-amine; propan-1-ol; rhodium(2+); triphenylphosphane Traditional Name: [(Z)-1-methyl-2-nitroso-prop-1-enyl]-oxido-amine; propan-1-ol; rhodium(2+); triphenylphosphine Formula: C55H66N8O9P2Rh2 MolecularWeight: 1250.919262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCO.CC(=C(C)N=O)N[O-].CC(=C(C)N=O)N[O-].CC(=C(C)N=O)N[O-].CC(=C(C)N=O)N[O-].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Rh+2].[Rh+2]

Isomeric SMILES

CCCO.C/C(=C(/N=O)\C)/N[O-].C/C(=C(/N=O)\C)/N[O-].C/C(=C(/N=O)\C)/N[O-].C/C(=C(/N=O)\C)/N[O-].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Rh+2].[Rh+2]

InChI

InChI=1S/2C18H15P.4C4H7N2O2.C3H8O.2Rh/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;4*1-3(5-7)4(2)6-8;1-2-3-4;;/h2*1-15H;4*5H,1-2H3;4H,2-3H2,1H3;;/q;;4*-1;;2*+2/b;;4*4-3-;;;