Geometry & MOs

Info

ID:	384734
PubChem CID:	134977588
Reduced:	ClPSN2C13H29 (1)
Stoich.:	ABCD2E13F29 (1)
Weight, g/mol:	343.068572
ΔH_f, kcal/mol:	-7.26
Dipole, Da:	22.14
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.897595
Charge, e:	0

Chem-info

IUPAC name:

[diethyl(sulfidocarbothioyl)phosphaniumyl]methanedithioate;triethylazanium

Drug info:

PubChemData

Smile

CC[P+](CC)(CC)/C(=N\N(C(C)C)C(C)C)/[S-].[Cl-]

DOS

IR

Vibrations