Geometry & MOs

Info

ID:	26203
PubChem CID:	641065
Reduced:	FN2O4C11H15 (1)
Stoich.:	AB2C4D11E15 (1)
Weight, g/mol:	272.117235
ΔH_f, kcal/mol:	-195.86
Dipole, Da:	6.05
IP(EA), eV:	-9.83(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxy-1-[(2R,4S,5R)-4-fluoro-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-4-one

Drug info:

PubChemData

Smile

CCOC1=NC(=O)C=CN1[C@H]2C[C@@H]([C@H](O2)CO)F

DOS

IR

Vibrations