Geometry & MOs

Info

ID:	232067
PubChem CID:	87575364
Reduced:	O2C5H8 (1)
Stoich.:	A2B5C8 (1)
Weight, g/mol:	264.012616
ΔH_f, kcal/mol:	-51.48
Dipole, Da:	1.76
IP(EA), eV:	-10.12(1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methylsulfonyl 2,3-dimethylbenzenesulfonate

Drug info:

PubChemData

Smile

CCC(C#CO)O

DOS

IR

Vibrations