Geometry & MOs

Info

ID:	409314
PubChem CID:	135082094
Reduced:	TiCl2H32C38 (1)
Stoich.:	AB2C32D38 (1)
Weight, g/mol:	488.250401
ΔH_f, kcal/mol:	87.51
Dipole, Da:	4.38
IP(EA), eV:	-6.99(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CC[C]2[C](C1)[CH][CH][C]2C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)[C]7[CH][CH][C]8[C]7CCCC8.Cl[Ti]Cl

DOS

IR

Vibrations