N,N-bis(2-butylphenyl)carbamodithioate; molybdenum

Systemtic Name: N,N-bis(2-butylphenyl)carbamodithioate; molybdenum Openeye Name: N,N-bis(2-butylphenyl)carbamodithioate; molybdenum CAS Name: N,N-bis(2-butylphenyl)carbamodithioate; molybdenum IUPAC Name: N,N-bis(2-butylphenyl)carbamodithioate; molybdenum Traditional Name: N,N-bis(2-butylphenyl)carbamodithioate; molybdenum Formula: C126H156MoN6S12-6 MolecularWeight: 2235.34704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1N(C2=CC=CC=C2CCCC)C(=S)[S-].CCCCC1=CC=CC=C1N(C2=CC=CC=C2CCCC)C(=S)[S-].CCCCC1=CC=CC=C1N(C2=CC=CC=C2CCCC)C(=S)[S-].CCCCC1=CC=CC=C1N(C2=CC=CC=C2CCCC)C(=S)[S-].CCCCC1=CC=CC=C1N(C2=CC=CC=C2CCCC)C(=S)[S-].CCCCC1=CC=CC=C1N(C2=CC=CC=C2CCCC)C(=S)[S-].[Mo]

Isomeric SMILES

CCCCC1=CC=CC=C1N(C2=CC=CC=C2CCCC)C(=S)[S-].CCCCC1=CC=CC=C1N(C2=CC=CC=C2CCCC)C(=S)[S-].CCCCC1=CC=CC=C1N(C2=CC=CC=C2CCCC)C(=S)[S-].CCCCC1=CC=CC=C1N(C2=CC=CC=C2CCCC)C(=S)[S-].CCCCC1=CC=CC=C1N(C2=CC=CC=C2CCCC)C(=S)[S-].CCCCC1=CC=CC=C1N(C2=CC=CC=C2CCCC)C(=S)[S-].[Mo]

InChI

InChI=1S/6C21H27NS2.Mo/c6*1-3-5-11-17-13-7-9-15-19(17)22(21(23)24)20-16-10-8-14-18(20)12-6-4-2;/h6*7-10,13-16H,3-6,11-12H2,1-2H3,(H,23,24);/p-6