Geometry & MOs

Info

ID:	216984
PubChem CID:	85087075
Reduced:	ClNO2S2H8C14 (1)
Stoich.:	ABC2D2E8F14 (1)
Weight, g/mol:	321.043567
ΔH_f, kcal/mol:	-21.86
Dipole, Da:	3.04
IP(EA), eV:	-9.19(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N'-[4-chloro-2-(N-hydroxy-C-phenylcarbonimidoyl)phenyl]ethanimidamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=CSC(=C2)C=C3C(=O)NC(=O)S3)Cl

DOS

IR

Vibrations