Geometry & MOs

Info

ID:

339713

PubChem CID:

127261715

Reduced:

SN2O4C11H16 (1)

Stoich.:

AB2C4D11E16 (1)

Weight, g/mol:

256.051778

ΔHf, kcal/mol:

-133.26

Dipole, Da:

6.26

IP(EA), eV:

-10.33(-0.7)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(benzenesulfonyl)prop-2-enyl N-aminocarbamate

Drug info:

PubChemData

Smile

CC(C)(COC(=O)NN)S(=O)(=O)C1=CC=CC=C1

DOS

IR

Vibrations