Geometry & MOs

Info

ID:	277125
PubChem CID:	103826870
Reduced:	BrClON3C13H13 (1)
Stoich.:	ABCD3E13F13 (1)
Weight, g/mol:	318.99747
ΔH_f, kcal/mol:	8.08
Dipole, Da:	1.31
IP(EA), eV:	-8.79(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-(1-methoxy-2-methylpropan-2-yl)benzamide

Drug info:

PubChemData

Smile

CC(C)N1C=C(C=N1)NC(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations