Geometry & MOs

Info

ID:	355413
PubChem CID:	127288476
Reduced:	O2N4C15H22 (1)
Stoich.:	A2B4C15D22 (1)
Weight, g/mol:	343.225977
ΔH_f, kcal/mol:	-71.77
Dipole, Da:	4.2
IP(EA), eV:	-9.1(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(2-ethylimidazol-1-yl)piperidine-1-carbonyl]bicyclo[3.3.1]nonan-9-one

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C2CCCN2C(=O)[C@H]3CCC(=O)N3

DOS

IR

Vibrations