Geometry & MOs

Info

ID:	4244
PubChem CID:	11032
Reduced:	NSO4C15H23 (1)
Stoich.:	ABC4D15E23 (1)
Weight, g/mol:	313.134779
ΔH_f, kcal/mol:	-166.35
Dipole, Da:	6.34
IP(EA), eV:	-9.75(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(dibutylsulfamoyl)benzoic acid

Drug info:

PubChemData

Smile

CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)O

DOS

IR

Vibrations