Geometry & MOs

Info

ID:	368193
PubChem CID:	127327744
Reduced:	SO2N4C14H24 (1)
Stoich.:	AB2C4D14E24 (1)
Weight, g/mol:	353.115775
ΔH_f, kcal/mol:	-53.81
Dipole, Da:	4.98
IP(EA), eV:	-9.3(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-5-[3-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]sulfonylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1CCCN(C1)S(=O)(=O)N2CCC(C2)C3=CN(N=C3)C

DOS

IR

Vibrations