Geometry & MOs

Info

ID:	229530
PubChem CID:	87567950
Reduced:	O3N5F6H21C24 (1)
Stoich.:	A3B5C6D21E24 (1)
Weight, g/mol:	520.107821
ΔH_f, kcal/mol:	-297.53
Dipole, Da:	6.01
IP(EA), eV:	-9.31(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(9H-fluoren-1-yl)phenyl]ethyl-(2,4,6-trimethylphenyl)azanide;titanium(3+);dichloride

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OC2=CC=CC(=C2C3=NC4=C(C=C3)C(N(C(N4OC(=O)C(F)(F)F)N)C)N)C(F)(F)F

DOS

IR

Vibrations