Geometry & MOs

Info

ID:	207934
PubChem CID:	80472363
Reduced:	NO2C11H19 (1)
Stoich.:	AB2C11D19 (1)
Weight, g/mol:	259.157229
ΔH_f, kcal/mol:	-88.07
Dipole, Da:	3.29
IP(EA), eV:	-9.75(1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methoxyphenyl)ethyl]bicyclo[3.1.0]hexane-3-carboxamide

Drug info:

PubChemData

Smile

CC(COC)NC(=O)C1CC2CC2C1

DOS

IR

Vibrations