Geometry & MOs

Info

ID:	345169
PubChem CID:	127268929
Reduced:	NSO3C13H17 (1)
Stoich.:	ABC3D13E17 (1)
Weight, g/mol:	321.106851
ΔH_f, kcal/mol:	-104.23
Dipole, Da:	7.64
IP(EA), eV:	-9.3(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bicyclo[2.2.1]heptanylmethyl)-1,1-dioxothiane-4-sulfonamide

Drug info:

PubChemData

Smile

CC1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)OCC3

DOS

IR

Vibrations