Geometry & MOs

Info

ID:	366362
PubChem CID:	127319835
Reduced:	O3N4C17H18 (1)
Stoich.:	A3B4C17D18 (1)
Weight, g/mol:	340.128388
ΔH_f, kcal/mol:	-66.41
Dipole, Da:	4.84
IP(EA), eV:	-8.7(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonyl)-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C1CC(=O)NC2=C1C=C(C=C2)OCC(=O)N3CCN4C=CN=C4C3

DOS

IR

Vibrations