Geometry & MOs

Info

ID:	26201
PubChem CID:	641041
Reduced:	OCl2C4H8 (1)
Stoich.:	AB2C4D8 (1)
Weight, g/mol:	438.1591
ΔH_f, kcal/mol:	-81.67
Dipole, Da:	1.65
IP(EA), eV:	-10.77(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,5R)-5-(2-ethoxy-4-oxopyrimidin-1-yl)-3-fluorooxolan-2-yl]methyl 4-phenylbenzoate

Drug info:

PubChemData

Smile

C(CCl)[C@@H](CCl)O

DOS

IR

Vibrations