Geometry & MOs

Info

ID:	409872
PubChem CID:	135082659
Reduced:	NAu2P2H28C31 (1)
Stoich.:	AB2C2D28E31 (1)
Weight, g/mol:	755.04192
ΔH_f, kcal/mol:	259.29
Dipole, Da:	18.0
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.897885
Charge, e:	0

Chem-info

IUPAC name:

[dimethanidyl(diphenyl)-lambda5-phosphanyl] N,N-diethylcarbamodithioate;gold(1+)

Drug info:

PubChemData

Smile

[CH2-][P+]([CH2-])(C1=CC=CC=C1)C2=CC=CC=C2.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=N3.[Au+].[Au+]

DOS

IR

Vibrations