Geometry & MOs

Info

ID:	353749
PubChem CID:	127285326
Reduced:	O2N3C21H29 (1)
Stoich.:	A2B3C21D29 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-75.39
Dipole, Da:	5.78
IP(EA), eV:	-9.33(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2CCN(CC2)CC(=O)NC3(CCC3)C4=CC=CC=C4

DOS

IR

Vibrations