Geometry & MOs

Info

ID:	301973
PubChem CID:	123106112
Reduced:	ClNSO4H14C16 (1)
Stoich.:	ABCD4E14F16 (1)
Weight, g/mol:	384.95389
ΔH_f, kcal/mol:	-119.15
Dipole, Da:	6.45
IP(EA), eV:	-9.13(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromophenyl)-2-[(3-chlorophenyl)methylsulfinyl]acetamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)CS(=O)CC(=O)NC2=CC=C(C=C2)C(=O)O

DOS

IR

Vibrations