Geometry & MOs

Info

ID:	282399
PubChem CID:	103925253
Reduced:	NOBr2F3H8C11 (1)
Stoich.:	ABC2D3E8F11 (1)
Weight, g/mol:	361.00376
ΔH_f, kcal/mol:	-162.46
Dipole, Da:	5.34
IP(EA), eV:	-10.13(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(1H-imidazol-2-ylmethyl)-N-methyl-2-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

C=C(CNC(=O)C1=C(C=C(C=C1)Br)C(F)(F)F)Br

DOS

IR

Vibrations