Geometry & MOs

Info

ID:	366111
PubChem CID:	127319472
Reduced:	ClNS2O5C13H16 (1)
Stoich.:	ABC2D5E13F16 (1)
Weight, g/mol:	257.108565
ΔH_f, kcal/mol:	-207.42
Dipole, Da:	7.73
IP(EA), eV:	-10.4(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)cyclohex-3-ene-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)CS(=O)(=O)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations