Geometry & MOs

Info

ID:	277093
PubChem CID:	103826685
Reduced:	BrClON2C16H22 (1)
Stoich.:	ABCD2E16F22 (1)
Weight, g/mol:	367.95633
ΔH_f, kcal/mol:	-53.2
Dipole, Da:	3.44
IP(EA), eV:	-8.76(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-[(4-nitrophenyl)methyl]benzamide

Drug info:

PubChemData

Smile

CC(C)(C)N1CCC(CC1)NC(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations