Geometry & MOs

Info

ID:	274127
PubChem CID:	103807205
Reduced:	ON4C14H18 (1)
Stoich.:	AB4C14D18 (1)
Weight, g/mol:	248.188863
ΔH_f, kcal/mol:	12.17
Dipole, Da:	7.77
IP(EA), eV:	-9.3(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(aminomethyl)cyclopentyl]tricyclo[3.2.1.02,4]octane-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(C(C1)NC(=O)C2=C3C=CC=CN3N=C2)CN

DOS

IR

Vibrations