Geometry & MOs

Info

ID:	269570
PubChem CID:	103617992
Reduced:	INOF3C13H15 (1)
Stoich.:	ABCD3E13F15 (1)
Weight, g/mol:	356.97429
ΔH_f, kcal/mol:	-181.54
Dipole, Da:	3.04
IP(EA), eV:	-9.68(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-chloro-N-propyl-N-(2,2,2-trifluoroethyl)benzamide

Drug info:

PubChemData

Smile

CCCN(CC(F)(F)F)C(=O)C1=CC=CC(=C1I)C

DOS

IR

Vibrations