Geometry & MOs

Info

ID:	298418
PubChem CID:	117649369
Reduced:	FNO4H22C27 (1)
Stoich.:	ABC4D22E27 (1)
Weight, g/mol:	741.278013
ΔH_f, kcal/mol:	-96.22
Dipole, Da:	3.56
IP(EA), eV:	-8.82(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[9-(4-phenoxyphenyl)carbazol-3-yl]-9-(9-phenylcarbazol-2-yl)carbazole

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(=O)NC2(CC3=CC=CC=C3C2)C(=O)O)C#CC4=CC=C(C=C4)CF

DOS

IR

Vibrations