Geometry & MOs

Info

ID:	401546
PubChem CID:	135051601
Reduced:	H5C7 (4)
Stoich.:	A5B7 (4)
Weight, g/mol:	336.097272
ΔH_f, kcal/mol:	123.14
Dipole, Da:	0.4
IP(EA), eV:	-8.64(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(Z)-2-phenanthren-9-ylethenyl]-1-benzothiophene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=C2C3=CC=CC=C3C4=CC=CC=C4C2=CC5=CC=CC=C5

DOS

IR

Vibrations