Geometry & MOs

Info

ID:	277191
PubChem CID:	103827235
Reduced:	BrClNO2H13C15 (1)
Stoich.:	ABCD2E13F15 (1)
Weight, g/mol:	318.99747
ΔH_f, kcal/mol:	-52.63
Dipole, Da:	2.99
IP(EA), eV:	-9.29(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-(3-hydroxy-2,2-dimethylpropyl)benzamide

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)O)NC(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations