Geometry & MOs

Info

ID:

215972

PubChem CID:

85085525

Reduced:

OC14H22 (1)

Stoich.:

AB14C22 (1)

Weight, g/mol:

206.043522

ΔHf, kcal/mol:

-54.7

Dipole, Da:

3.28

IP(EA), eV:

-9.57(0.94)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

9-methyl-8-oxa-1,4-dithiaspiro[4.5]decan-7-ol

Drug info:

PubChemData

Smile

CC1CCC2C(=C)C1(CCC2=CCO)C

DOS

IR

Vibrations