Geometry & MOs

Info

ID:	167946
PubChem CID:	74902857
Reduced:	SN2O5H20C21 (1)
Stoich.:	AB2C5D20E21 (1)
Weight, g/mol:	401.089082
ΔH_f, kcal/mol:	-120.45
Dipole, Da:	7.14
IP(EA), eV:	-9.02(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chlorophenyl)-2-morpholin-4-yl-4,7-dioxo-1,6-dihydropyrido[2,3-d]pyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CCC(C(=O)O)OC1=CC=CC=C1C=C2C(=O)N=C(S2)NC3=CC(=CC=C3)OC

DOS

IR

Vibrations