Geometry & MOs

Info

ID:	388805
PubChem CID:	134990284
Reduced:	OCl2N2C15H16 (1)
Stoich.:	AB2C2D15E16 (1)
Weight, g/mol:	426.99747
ΔH_f, kcal/mol:	-18.67
Dipole, Da:	6.9
IP(EA), eV:	-8.69(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzoyl-N-[2-(bromomethyl)-3-chlorophenyl]benzamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(C2=C3C=C(C=CC3=NC(=O)CN2)Cl)Cl

DOS

IR

Vibrations