Geometry & MOs

Info

ID:	285483
PubChem CID:	104109360
Reduced:	SN2O4C14H20 (1)
Stoich.:	AB2C4D14E20 (1)
Weight, g/mol:	315.114044
ΔH_f, kcal/mol:	-166.53
Dipole, Da:	4.16
IP(EA), eV:	-9.41(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-(4-hydroxypentan-2-ylsulfamoyl)benzoate

Drug info:

PubChemData

Smile

CC(CC(C)O)NS(=O)(=O)C1=CC2=C(C=C1)N(C(=O)C2)C

DOS

IR

Vibrations