Geometry & MOs

Info

ID:	27550
PubChem CID:	822004
Reduced:	BrS2H7C11 (1)
Stoich.:	AB2C7D11 (1)
Weight, g/mol:	304.043712
ΔH_f, kcal/mol:	63.67
Dipole, Da:	2.12
IP(EA), eV:	-8.54(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(benzylamino)-N-(4-chlorophenyl)-2-sulfanylideneacetamide

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C3=CC=CC=C3S2)Br

DOS

IR

Vibrations