Geometry & MOs

Info

ID:	405763
PubChem CID:	135075316
Reduced:	O2C7H7 (2)
Stoich.:	A2B7C7 (2)
Weight, g/mol:	367.087829
ΔH_f, kcal/mol:	-137.53
Dipole, Da:	4.99
IP(EA), eV:	-9.65(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1,3-benzodioxol-5-yl)phenyl]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)OC1=CC2=C(C=C1)C(=O)C=CO2

DOS

IR

Vibrations