Geometry & MOs

Info

ID:	216238
PubChem CID:	85085933
Reduced:	O4C13H24 (1)
Stoich.:	A4B13C24 (1)
Weight, g/mol:	244.113316
ΔH_f, kcal/mol:	-222.5
Dipole, Da:	2.22
IP(EA), eV:	-10.2(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-cyclohexyl-3-methylidenecyclobutyl) methanesulfonate

Drug info:

PubChemData

Smile

CCCCCCC1CC(OC(O1)C)OC(=O)C

DOS

IR

Vibrations