Geometry & MOs

Info

ID:	277074
PubChem CID:	103826614
Reduced:	BrClON4C12H12 (1)
Stoich.:	ABCD4E12F12 (1)
Weight, g/mol:	366.99747
ΔH_f, kcal/mol:	18.52
Dipole, Da:	3.92
IP(EA), eV:	-10.04(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-[[3-(methoxymethyl)phenyl]methyl]benzamide

Drug info:

PubChemData

Smile

CCN1C=NN=C1CNC(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations