Geometry & MOs

Info

ID:	399721
PubChem CID:	135042053
Reduced:	OC15H22 (1)
Stoich.:	AB15C22 (1)
Weight, g/mol:	141.001026
ΔH_f, kcal/mol:	-50.95
Dipole, Da:	2.73
IP(EA), eV:	-9.52(0.68)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

cyclohexatrienesulfinic acid

Drug info:

PubChemData

Smile

C[C@]1([C@H]2C=CCC[C@H]2C1=O)C3CCCCC3

DOS

IR

Vibrations