Geometry & MOs

Info

ID:	12139
PubChem CID:	131278
Reduced:	SO4C10H16 (1)
Stoich.:	AB4C10D16 (1)
Weight, g/mol:	232.07693
ΔH_f, kcal/mol:	-180.14
Dipole, Da:	6.73
IP(EA), eV:	-10.07(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonic acid

Drug info:

PubChemData

Smile

CC1(C2CC[C@@]1(C(=O)C2)CS(=O)(=O)O)C

DOS

IR

Vibrations