Geometry & MOs

Info

ID:	279204
PubChem CID:	103842020
Reduced:	BrClON2C16H20 (1)
Stoich.:	ABCD2E16F20 (1)
Weight, g/mol:	306.91663
ΔH_f, kcal/mol:	-32.18
Dipole, Da:	4.59
IP(EA), eV:	-8.93(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-N-(2-chloroprop-2-enyl)benzamide

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1C(=O)C3=CC(=C(C=C3)Cl)Br

DOS

IR

Vibrations