Geometry & MOs

Info

ID:	395947
PubChem CID:	135027005
Reduced:	SN2O2H22C23 (1)
Stoich.:	AB2C2D22E23 (1)
Weight, g/mol:	408.130777
ΔH_f, kcal/mol:	21.33
Dipole, Da:	4.6
IP(EA), eV:	-8.91(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-[(E)-1-(4-fluorophenyl)-3-phenylbut-2-enylidene]amino]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N/N=C(\C=C(/C)\C2=CC=CC=C2)/C3=CC=CC=C3

DOS

IR

Vibrations