Geometry & MOs

Info

ID:	158559
PubChem CID:	56464175
Reduced:	SN2O4C21H26 (1)
Stoich.:	AB2C4D21E26 (1)
Weight, g/mol:	415.9864
ΔH_f, kcal/mol:	-143.38
Dipole, Da:	7.42
IP(EA), eV:	-9.11(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-N-(2-ethylsulfonylethyl)acetamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(=O)C1CCCN(C1)C(=O)C2=CC=CC3=CC=CC=C32

DOS

IR

Vibrations