Geometry & MOs

Info

ID:	272909
PubChem CID:	103764971
Reduced:	BrClN2O3H12C14 (1)
Stoich.:	ABC2D3E12F14 (1)
Weight, g/mol:	317.0182
ΔH_f, kcal/mol:	-84.4
Dipole, Da:	5.05
IP(EA), eV:	-9.27(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-4-chloro-N-(3,3-dimethylbutan-2-yl)benzamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1Br)Cl)NC(=O)C2=CC(=O)NC=C2

DOS

IR

Vibrations