Geometry & MOs

Info

ID:

344842

PubChem CID:

127268602

Reduced:

N2S2O5C16H22 (1)

Stoich.:

A2B2C5D16E22 (1)

Weight, g/mol:

329.07555

ΔHf, kcal/mol:

-195.23

Dipole, Da:

7.14

IP(EA), eV:

-9.0(-0.34)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-(2-phenylazetidin-1-yl)sulfonylthiane 1,1-dioxide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2=CC=CC(=C2)CNS(=O)(=O)C3CCS(=O)(=O)CC3

DOS

IR

Vibrations