Geometry & MOs

Info

ID:	386029
PubChem CID:	134980577
Reduced:	N2C17H24 (1)
Stoich.:	A2B17C24 (1)
Weight, g/mol:	380.090472
ΔH_f, kcal/mol:	62.86
Dipole, Da:	2.39
IP(EA), eV:	-8.44(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-4-(benzenesulfonyl)-3-phenylsulfanylbut-2-enyl]benzene

Drug info:

PubChemData

Smile

CN(C)/N=C(\C/C=C/CCCC=C)/C1=CC=CC=C1

DOS

IR

Vibrations