Geometry & MOs

Info

ID:	346445
PubChem CID:	127270949
Reduced:	N3O3C21H23 (1)
Stoich.:	A3B3C21D23 (1)
Weight, g/mol:	349.272927
ΔH_f, kcal/mol:	-50.37
Dipole, Da:	4.47
IP(EA), eV:	-8.29(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopentyl-N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1)C(=O)N3CCC4=CC(=C(C=C4CC3)OC)OC)NN=C2

DOS

IR

Vibrations