Geometry & MOs

Info

ID:	149168
PubChem CID:	53788840
Reduced:	NO5C15H15 (1)
Stoich.:	AB5C15D15 (1)
Weight, g/mol:	513.90393
ΔH_f, kcal/mol:	-146.57
Dipole, Da:	2.12
IP(EA), eV:	-9.7(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3S,5R)-3-hydroxy-5-(5-iodo-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl phosphono hydrogen phosphate

Drug info:

PubChemData

Smile

C1C2N(C1=O)C(C(=CCO)O2)OC(=O)CC3=CC=CC=C3

DOS

IR

Vibrations