Geometry & MOs

Info

ID:	332882
PubChem CID:	127251306
Reduced:	SO4N5C15H21 (1)
Stoich.:	AB4C5D15E21 (1)
Weight, g/mol:	422.195405
ΔH_f, kcal/mol:	-134.34
Dipole, Da:	4.58
IP(EA), eV:	-9.65(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[1-[3-(4-methoxyphenyl)propanoyl]pyrrolidin-3-yl]-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=N2)C3CCN(C3)S(=O)(=O)N(C)C)C(=O)N(C1=O)C

DOS

IR

Vibrations