Geometry & MOs

Info

ID:	289477
PubChem CID:	104357277
Reduced:	BrClNOC12H15 (1)
Stoich.:	ABCDE12F15 (1)
Weight, g/mol:	402.87972
ΔH_f, kcal/mol:	-30.09
Dipole, Da:	3.66
IP(EA), eV:	-9.12(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-(4-bromo-3-methylphenyl)-2-chlorobenzamide

Drug info:

PubChemData

Smile

C1CC(OC1)CNCC2=C(C(=CC=C2)Br)Cl

DOS

IR

Vibrations