Geometry & MOs

Info

ID:	353616
PubChem CID:	127285193
Reduced:	N3O4C19H25 (1)
Stoich.:	A3B4C19D25 (1)
Weight, g/mol:	373.175004
ΔH_f, kcal/mol:	-170.43
Dipole, Da:	3.35
IP(EA), eV:	-8.76(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-acetylpiperidin-4-yl)methyl]-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)CNC(=O)COC2=CC3=C(C=C2)NC(=O)CC3

DOS

IR

Vibrations