Geometry & MOs

Info

ID:	15852
PubChem CID:	453690
Reduced:	N2P3C11O12H19 (1)
Stoich.:	A2B3C11D12E19 (1)
Weight, g/mol:	464.015085
ΔH_f, kcal/mol:	-709.57
Dipole, Da:	6.2
IP(EA), eV:	-9.48(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[hydroxy(phosphonooxy)phosphoryl]oxy-[[(1R,3S)-3-(5-methyl-2,4-dioxopyrimidin-1-yl)cyclopentyl]oxymethyl]phosphinic acid

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@H]2CC[C@H](C2)OCP(=O)(O)OP(=O)(O)OP(=O)(O)O

DOS

IR

Vibrations