Geometry & MOs

Info

ID:	442132
PubChem CID:	135250008
Reduced:	ON5H17C21 (1)
Stoich.:	AB5C17D21 (1)
Weight, g/mol:	804.33204
ΔH_f, kcal/mol:	65.6
Dipole, Da:	7.9
IP(EA), eV:	-8.56(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-[7,7-diphenyl-9-[5-(4,4,5,5-tetramethyl-1,3-thiazol-2-yl)pyridin-2-yl]benzo[c]fluoren-5-yl]pyridin-3-yl]-4,4,5,5-tetramethyl-1,3-thiazole

Drug info:

PubChemData

Smile

C1CC(=CCC1C#N)C2=C3C=CNC3=NC=C2C4=CC5=C(C=C4)NC(=O)N5

DOS

IR

Vibrations