Geometry & MOs

Info

ID:	23356
PubChem CID:	603188
Reduced:	BrNOH14C15 (1)
Stoich.:	ABCD14E15 (1)
Weight, g/mol:	303.02588
ΔH_f, kcal/mol:	-6.77
Dipole, Da:	2.96
IP(EA), eV:	-8.75(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(2,5-dimethylphenyl)benzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations