Geometry & MOs

Info

ID:	333513
PubChem CID:	127252065
Reduced:	N4O4C21H22 (1)
Stoich.:	A4B4C21D22 (1)
Weight, g/mol:	392.184841
ΔH_f, kcal/mol:	-115.49
Dipole, Da:	5.41
IP(EA), eV:	-9.5(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-7-[1-(3-phenylpropanoyl)pyrrolidin-3-yl]pyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=N2)C3CN(CCO3)C(=O)CC4=CC=CC=C4)C(=O)N(C1=O)C

DOS

IR

Vibrations