Geometry & MOs

Info

ID:	69077
PubChem CID:	46517820
Reduced:	FN2O4C17H19 (1)
Stoich.:	AB2C4D17E19 (1)
Weight, g/mol:	358.083268
ΔH_f, kcal/mol:	-156.93
Dipole, Da:	3.54
IP(EA), eV:	-8.8(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OC)F)NC(=O)CN(C)C(=O)C2=CC=CO2

DOS

IR

Vibrations