Geometry & MOs

Info

ID:	201824
PubChem CID:	79589060
Reduced:	NS2O3C12H15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	269.085242
ΔH_f, kcal/mol:	-53.6
Dipole, Da:	4.54
IP(EA), eV:	-9.16(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethylpropane-1-sulfonamide

Drug info:

PubChemData

Smile

CC1CN(S(=O)(=O)C1)CC2=CC(=CS2)C#CCO

DOS

IR

Vibrations