Geometry & MOs

Info

ID:	197514
PubChem CID:	78974242
Reduced:	BrNOC16H22 (1)
Stoich.:	ABCD16E22 (1)
Weight, g/mol:	279.138992
ΔH_f, kcal/mol:	-8.82
Dipole, Da:	1.4
IP(EA), eV:	-8.78(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chlorophenyl)-2-[cyclopropyl(3-methylbutyl)amino]ethanone

Drug info:

PubChemData

Smile

CC(C)CCN(CC(=O)C1=CC=C(C=C1)Br)C2CC2

DOS

IR

Vibrations