Geometry & MOs

Info

ID:	204100
PubChem CID:	79912246
Reduced:	OSC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	266.188195
ΔH_f, kcal/mol:	-80.25
Dipole, Da:	3.98
IP(EA), eV:	-8.56(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohex-3-en-1-yl(1,9-dioxaspiro[5.5]undecan-4-yl)methanol

Drug info:

PubChemData

Smile

C1COC2(CCSC2)CC1SC3=CC=C(C=C3)O

DOS

IR

Vibrations