Geometry & MOs

Info

ID:	155540
PubChem CID:	56365876
Reduced:	ON2C13H19 (2)
Stoich.:	AB2C13D19 (2)
Weight, g/mol:	463.247107
ΔH_f, kcal/mol:	-71.22
Dipole, Da:	4.36
IP(EA), eV:	-8.72(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzoylpiperidin-4-yl)-2-[4-(2-oxopyrrolidin-1-yl)phenoxy]-N-propylacetamide

Drug info:

PubChemData

Smile

CCCN(C1CCN(CC1)C(=O)C2=CC=CC=C2)C(=O)CC3=C(N(N=C3C)CC(C)C)C

DOS

IR

Vibrations