Geometry & MOs

Info

ID:	410254
PubChem CID:	135083045
Reduced:	PN2O9C10H15 (1)
Stoich.:	AB2C9D10E15 (1)
Weight, g/mol:	222.037567
ΔH_f, kcal/mol:	-451.36
Dipole, Da:	7.1
IP(EA), eV:	-9.77(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (4R,5R)-2-hydroperoxy-1,3-dioxolane-4,5-dicarboxylate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations