Geometry & MOs

Info

ID:	277117
PubChem CID:	103826802
Reduced:	BrClON3H13C14 (1)
Stoich.:	ABCD3E13F14 (1)
Weight, g/mol:	356.97429
ΔH_f, kcal/mol:	13.69
Dipole, Da:	2.58
IP(EA), eV:	-9.01(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)benzamide

Drug info:

PubChemData

Smile

CN(C)C1=C(C=CC=N1)NC(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations