Geometry & MOs

Info

ID:	68738
PubChem CID:	46509010
Reduced:	SN2O5C20H20 (1)
Stoich.:	AB2C5D20E20 (1)
Weight, g/mol:	409.075072
ΔH_f, kcal/mol:	-127.11
Dipole, Da:	3.11
IP(EA), eV:	-9.89(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chlorophenyl)methyl 4-(oxolan-2-ylmethylsulfamoyl)benzoate

Drug info:

PubChemData

Smile

C1CC(OC1)CNS(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=C(C=C3)C#N

DOS

IR

Vibrations