Geometry & MOs

Info

ID:	295470
PubChem CID:	117530125
Reduced:	ON2C12H18 (1)
Stoich.:	AB2C12D18 (1)
Weight, g/mol:	242.034586
ΔH_f, kcal/mol:	-4.0
Dipole, Da:	3.46
IP(EA), eV:	-8.86(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-chloro-2-methoxyphenyl)oxetane-3-carboxylic acid

Drug info:

PubChemData

Smile

CN1CC(C1)(CN)C2=CC(=CC=C2)OC

DOS

IR

Vibrations