Geometry & MOs

Info

ID:	272266
PubChem CID:	103737270
Reduced:	BrNOC13H16 (1)
Stoich.:	ABCD13E16 (1)
Weight, g/mol:	169.146664
ΔH_f, kcal/mol:	-16.86
Dipole, Da:	3.5
IP(EA), eV:	-9.5(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethylcyclopropyl)methyl]butanamide

Drug info:

PubChemData

Smile

CCC1(CC1)CNC(=O)C2=CC=CC=C2Br

DOS

IR

Vibrations