Geometry & MOs

Info

ID:	444839
PubChem CID:	135263695
Reduced:	NO2C8H11 (1)
Stoich.:	AB2C8D11 (1)
Weight, g/mol:	164.068473
ΔH_f, kcal/mol:	-66.48
Dipole, Da:	1.92
IP(EA), eV:	-8.28(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-hydroxyethoxy)ethyl ethaneperoxoate

Drug info:

PubChemData

Smile

CC(=O)OCN1CC=CC=C1

DOS

IR

Vibrations