Geometry & MOs

Info

ID:	409312
PubChem CID:	135082092
Reduced:	TiCl2H28C40 (1)
Stoich.:	AB2C28D40 (1)
Weight, g/mol:	508.219101
ΔH_f, kcal/mol:	294.18
Dipole, Da:	6.26
IP(EA), eV:	-8.16(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)C[C]5[CH][CH][C]6[C]5C=CC=C6)C[C]7[CH][CH][C]8[C]7C=CC=C8.Cl[Ti]Cl

DOS

IR

Vibrations