Geometry & MOs

Info

ID:	379583
PubChem CID:	134447692
Reduced:	NC29H39 (1)
Stoich.:	AB29C39 (1)
Weight, g/mol:	566.145285
ΔH_f, kcal/mol:	75.44
Dipole, Da:	2.45
IP(EA), eV:	-8.62(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(7-dibenzofuran-3-yldibenzothiophen-3-yl)-1H-phenanthro[9,10-d]imidazole

Drug info:

PubChemData

Smile

CCC1=CCC=C(C=C1C)/C(=C(\C)/C(=C(/C=C(\C(=C)C)/C(=C)N)\C2CC2)/C)/C=C\C

DOS

IR

Vibrations