Geometry & MOs

Info

ID:	329742
PubChem CID:	127246609
Reduced:	OSN3C18H21 (1)
Stoich.:	ABC3D18E21 (1)
Weight, g/mol:	329.148789
ΔH_f, kcal/mol:	-0.26
Dipole, Da:	4.63
IP(EA), eV:	-8.88(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-6-[3-(4-methylpyrimidin-2-yl)pyrrolidine-1-carbonyl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1)C2CCN(C2)C(=O)C3=CSC4=C3CCCC4

DOS

IR

Vibrations