Geometry & MOs

Info

ID:	270986
PubChem CID:	103639094
Reduced:	BrNOH14C15 (1)
Stoich.:	ABCD14E15 (1)
Weight, g/mol:	331.05718
ΔH_f, kcal/mol:	-7.22
Dipole, Da:	4.68
IP(EA), eV:	-8.96(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromo-2-methylphenyl)-2-phenylbutanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)NC2=C(C(=CC=C2)Br)C

DOS

IR

Vibrations