Geometry & MOs

Info

ID:	263326
PubChem CID:	103357426
Reduced:	N3O3C14H19 (1)
Stoich.:	A3B3C14D19 (1)
Weight, g/mol:	265.142641
ΔH_f, kcal/mol:	-79.4
Dipole, Da:	4.62
IP(EA), eV:	-8.78(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(3-hydroxy-3-methylpyrrolidin-1-yl)-2-oxoethyl]-4,6-dimethyl-1H-pyrimidin-2-one

Drug info:

PubChemData

Smile

CC1(CCN(C1)C(=O)C(C2=CC=CC=C2)/C(=N/O)/N)O

DOS

IR

Vibrations