Geometry & MOs

Info

ID:	207930
PubChem CID:	80472359
Reduced:	ON3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	179.131014
ΔH_f, kcal/mol:	-6.22
Dipole, Da:	5.65
IP(EA), eV:	-9.38(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylmethyl)bicyclo[3.1.0]hexane-3-carboxamide

Drug info:

PubChemData

Smile

C1C2C1CC(C2)C(=O)NCCCN3C=CN=C3

DOS

IR

Vibrations