Geometry & MOs

Info

ID:	46229
PubChem CID:	10523417
Reduced:	I2O2H4C7 (1)
Stoich.:	A2B2C4D7 (1)
Weight, g/mol:	374.112544
ΔH_f, kcal/mol:	-3.61
Dipole, Da:	1.96
IP(EA), eV:	-9.09(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2R,3S,5R)-5-(5-fluoro-2,4-dioxopyrimidin-1-yl)-2-(hydroxymethyl)-2,5-dimethyloxolan-3-yl]oxy-4-oxobutanoic acid

Drug info:

PubChemData

Smile

C1OC2=C(O1)C(=C(C=C2)I)I

DOS

IR

Vibrations