N,N-bis(phenylmethyl)carbamodithioate; molybdenum

Systemtic Name: N,N-bis(phenylmethyl)carbamodithioate; molybdenum Openeye Name: N,N-dibenzylcarbamodithioate; molybdenum CAS Name: N,N-bis(phenylmethyl)carbamodithioate; molybdenum IUPAC Name: N,N-dibenzylcarbamodithioate; molybdenum Traditional Name: N,N-dibenzylcarbamodithioate; molybdenum Formula: C90H84MoN6S12-6 MolecularWeight: 1730.39016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].[Mo]

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].[Mo]

InChI

InChI=1S/6C15H15NS2.Mo/c6*17-15(18)16(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14;/h6*1-10H,11-12H2,(H,17,18);/p-6