Geometry & MOs

Info

ID:	368172
PubChem CID:	127327723
Reduced:	SO2N4C15H26 (1)
Stoich.:	AB2C4D15E26 (1)
Weight, g/mol:	390.111024
ΔH_f, kcal/mol:	-60.59
Dipole, Da:	4.86
IP(EA), eV:	-9.3(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-6-[3-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]sulfonylpyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1CC(CN(C1)S(=O)(=O)N2CCC(C2)C3=CN(N=C3)C)C

DOS

IR

Vibrations