Geometry & MOs

Info

ID:	47869
PubChem CID:	10535699
Reduced:	SC12H14 (1)
Stoich.:	AB12C14 (1)
Weight, g/mol:	190.156668
ΔH_f, kcal/mol:	57.89
Dipole, Da:	1.6
IP(EA), eV:	-8.26(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,3,4,5-pentadeuterio-6-[(E)-2-(2,3,4,5,6-pentadeuteriophenyl)ethenyl]benzene

Drug info:

PubChemData

Smile

CCC#CSC(C)C1=CC=CC=C1

DOS

IR

Vibrations