Geometry & MOs

Info

ID:	384810
PubChem CID:	134977714
Reduced:	OSC11H16 (1)
Stoich.:	ABC11D16 (1)
Weight, g/mol:	331.124215
ΔH_f, kcal/mol:	-31.98
Dipole, Da:	2.35
IP(EA), eV:	-9.19(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[(Z)-2-methyl-1-phenoxybut-2-enyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCSC(=O)C1=CCCCC1C=C

DOS

IR

Vibrations