Geometry & MOs

Info

ID:	378329
PubChem CID:	134224407
Reduced:	FN2O4C10H15 (1)
Stoich.:	AB2C4D10E15 (1)
Weight, g/mol:	226.131742
ΔH_f, kcal/mol:	-217.63
Dipole, Da:	3.94
IP(EA), eV:	-8.8(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2R,4S,5S)-5-(hydroxymethyl)-4-methyloxolan-2-yl]-5-methyl-1,6-dihydropyrimidin-2-one

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1)[C@@H]2C([C@H]([C@@H](O2)CO)O)F

DOS

IR

Vibrations