Geometry & MOs

Info

ID:	354976
PubChem CID:	127287837
Reduced:	N3O5C18H23 (1)
Stoich.:	A3B5C18D23 (1)
Weight, g/mol:	375.179421
ΔH_f, kcal/mol:	-190.57
Dipole, Da:	3.8
IP(EA), eV:	-8.68(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[1-(2,4-dimethoxybenzoyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1)C(=O)N2CCCC2)NC(=O)[C@H]3CCC(=O)N3)OC

DOS

IR

Vibrations