Geometry & MOs

Info

ID:	279141
PubChem CID:	103841657
Reduced:	BrClON2C15H18 (1)
Stoich.:	ABCD2E15F18 (1)
Weight, g/mol:	387.90171
ΔH_f, kcal/mol:	-29.89
Dipole, Da:	5.07
IP(EA), eV:	-8.92(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-N-(2-chloro-5-nitrophenyl)benzamide

Drug info:

PubChemData

Smile

C1CCN2CCC(C2C1)NC(=O)C3=CC(=C(C=C3)Cl)Br

DOS

IR

Vibrations