Geometry & MOs

Info

ID:	336973
PubChem CID:	127256538
Reduced:	PN2O11C13H17 (1)
Stoich.:	AB2C11D13E17 (1)
Weight, g/mol:	436.02597
ΔH_f, kcal/mol:	-524.4
Dipole, Da:	4.5
IP(EA), eV:	-10.61(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

disodium;2-[[(2R,3S,4S,5R)-5-(5-ethenyl-2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]acetate

Drug info:

PubChemData

Smile

CC(=O)C1=CN(C(=O)NC1=O)[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O

DOS

IR

Vibrations