Geometry & MOs

Info

ID:	386718
PubChem CID:	134982677
Reduced:	SiO2C9H18 (2)
Stoich.:	AB2C9D18 (2)
Weight, g/mol:	306.128966
ΔH_f, kcal/mol:	-281.85
Dipole, Da:	0.94
IP(EA), eV:	-8.78(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(benzenesulfonyl)cyclopent-3-en-1-yl]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CC1(O[C@@H]2[C@H](O/C(=C\[Si](C)(C)C)/[C@@H]2O1)CO[Si](C)(C)C(C)(C)C)C

DOS

IR

Vibrations