Geometry & MOs

Info

ID:	225802
PubChem CID:	87226251
Reduced:	NO2C13H13 (1)
Stoich.:	AB2C13D13 (1)
Weight, g/mol:	180.009245
ΔH_f, kcal/mol:	-31.94
Dipole, Da:	6.65
IP(EA), eV:	-8.45(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethenylsulfonylethyl hydrogen carbonate

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)N/C=C\2/C=COC2=O

DOS

IR

Vibrations