Geometry & MOs

Info

ID:	391266
PubChem CID:	135004008
Reduced:	NO4H25C30 (1)
Stoich.:	AB4C25D30 (1)
Weight, g/mol:	281.173942
ΔH_f, kcal/mol:	-42.21
Dipole, Da:	5.85
IP(EA), eV:	-8.98(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-hydroxy-1,3-dimethyl-5-(1-methyl-4-propan-2-ylpyrrolidin-3-yl)pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC(=O)C1([C@@H]2C3=CC=CC=C3C=CN2/C(=C/C(=O)C4=CC=CC=C4)/[C@]1(C5=CC=CC=C5)O)C(=O)C

DOS

IR

Vibrations