Geometry & MOs

Info

ID:	192594
PubChem CID:	78288425
Reduced:	SN3O5H15C19 (1)
Stoich.:	AB3C5D15E19 (1)
Weight, g/mol:	467.036099
ΔH_f, kcal/mol:	-107.47
Dipole, Da:	3.82
IP(EA), eV:	-9.03(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-oxocyclopentyl) 2-chloro-5-[(4-chlorophenyl)-prop-2-enylsulfamoyl]benzoate

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N(C(=O)S3)CCNC(=O)C4=CC=NC=C4

DOS

IR

Vibrations