Geometry & MOs

Info

ID:	53366
PubChem CID:	14710719
Reduced:	ClOSN2H7C9 (1)
Stoich.:	ABCD2E7F9 (1)
Weight, g/mol:	680.39124
ΔH_f, kcal/mol:	-15.12
Dipole, Da:	2.99
IP(EA), eV:	-9.14(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,3-bis[bis[di(propan-2-yl)amino]phosphinothioyl]-N,4-dimethyl-5-oxo-1,2,4-triazole-1-carboxamide

Drug info:

PubChemData

Smile

CN1C(=O)C2=C(C=CC(=C2)Cl)NC1=S

DOS

IR

Vibrations