Geometry & MOs

Info

ID:	376534
PubChem CID:	134222552
Reduced:	O4C15H24 (1)
Stoich.:	A4B15C24 (1)
Weight, g/mol:	280.061674
ΔH_f, kcal/mol:	-214.93
Dipole, Da:	3.84
IP(EA), eV:	-10.75(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-bis(methoxycarbonyl)cyclohexane-1-sulfonic acid

Drug info:

PubChemData

Smile

C1CC(CCC1CC2CCC(CC2)OC=O)C(=O)O

DOS

IR

Vibrations