Geometry & MOs

Info

ID:	18828
PubChem CID:	548764
Reduced:	OC5H6 (2)
Stoich.:	AB5C6 (2)
Weight, g/mol:	164.08373
ΔH_f, kcal/mol:	-43.65
Dipole, Da:	5.03
IP(EA), eV:	-10.1(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4'-methylspiro[bicyclo[2.2.1]hept-2-ene-5,3'-oxetane]-2'-one

Drug info:

PubChemData

Smile

CC1C2(CC3CC2C=C3)C(=O)O1

DOS

IR

Vibrations