Geometry & MOs

Info

ID:	277087
PubChem CID:	103826654
Reduced:	BrClN2O2C14H16 (1)
Stoich.:	ABC2D2E14F16 (1)
Weight, g/mol:	318.99747
ΔH_f, kcal/mol:	-84.52
Dipole, Da:	2.35
IP(EA), eV:	-9.66(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-(1-methoxypropan-2-yl)-N-methylbenzamide

Drug info:

PubChemData

Smile

CC(=O)NC1CCCN(C1)C(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations