Geometry & MOs

Info

ID:	182037
PubChem CID:	76832481
Reduced:	S2H22C29 (1)
Stoich.:	A2B22C29 (1)
Weight, g/mol:	400.095558
ΔH_f, kcal/mol:	181.03
Dipole, Da:	0.66
IP(EA), eV:	-8.65(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5-diphenyl-3-(2-thiophen-2-ylthiophen-3-yl)penta-1,4-dien-3-ol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=CC=CC2(C3=C(C4=C2C=CS4)SC=C3)C=CC=CC5=CC=CC=C5

DOS

IR

Vibrations