Geometry & MOs

Info

ID:	404713
PubChem CID:	135069820
Reduced:	O4C19H22 (1)
Stoich.:	A4B19C22 (1)
Weight, g/mol:	620.26392
ΔH_f, kcal/mol:	-147.69
Dipole, Da:	6.08
IP(EA), eV:	-9.03(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-fluoro-2-[2-[2-(7-fluoro-9-methyl-4-phenylcarbazol-2-yl)ethoxy]ethyl]-9-methyl-4-phenylcarbazole

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@H]2CC(C(=O)C3=C2CCCC3)C(=O)OC

DOS

IR

Vibrations