Geometry & MOs

Info

ID:	394042
PubChem CID:	135022208
Reduced:	OS2H18C25 (1)
Stoich.:	AB2C18D25 (1)
Weight, g/mol:	396.100643
ΔH_f, kcal/mol:	89.28
Dipole, Da:	4.05
IP(EA), eV:	-9.12(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methyl-2,4-diphenyl-5-thiophen-2-ylcyclopenta-1,3-dien-1-yl)thiophene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2C(C(=C(C2=O)C3=CC=CC=C3)C4=CC=CS4)C5=CC=CS5

DOS

IR

Vibrations