Geometry & MOs

Info

ID:	272895
PubChem CID:	103764192
Reduced:	BrClNO3C13H15 (1)
Stoich.:	ABCD3E13F15 (1)
Weight, g/mol:	303.00255
ΔH_f, kcal/mol:	-124.55
Dipole, Da:	4.0
IP(EA), eV:	-9.53(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-4-chloro-N-(2,2-dimethylpropyl)benzamide

Drug info:

PubChemData

Smile

CCN(CC(=O)OCC)C(=O)C1=C(C=C(C=C1)Cl)Br

DOS

IR

Vibrations