Geometry & MOs

Info

ID:

198285

PubChem CID:

79080084

Reduced:

SO2N3C14H23 (1)

Stoich.:

AB2C3D14E23 (1)

Weight, g/mol:

168.151415

ΔHf, kcal/mol:

-81.29

Dipole, Da:

4.64

IP(EA), eV:

-8.98(-0.16)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(3-methylcyclohexyl)cyclobutan-1-ol

Drug info:

PubChemData

Smile

CC(C)(CNC1CCCC2=C1N=CC=C2)NS(=O)(=O)C

DOS

IR

Vibrations