Geometry & MOs

Info

ID:	271994
PubChem CID:	103709193
Reduced:	SN2O2C8H12 (1)
Stoich.:	AB2C2D8E12 (1)
Weight, g/mol:	340.98853
ΔH_f, kcal/mol:	-68.5
Dipole, Da:	2.3
IP(EA), eV:	-9.62(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-fluoro-N-methyl-N-(2-thiophen-2-ylethyl)benzamide

Drug info:

PubChemData

Smile

CCC1=CN=C(S1)CNC(=O)OC

DOS

IR

Vibrations