Geometry & MOs

Info

ID:	401259
PubChem CID:	135050722
Reduced:	TiO4C16H36 (1)
Stoich.:	AB4C16D36 (1)
Weight, g/mol:	883.6855
ΔH_f, kcal/mol:	-270.35
Dipole, Da:	4.71
IP(EA), eV:	-9.14(-2.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tribenzylindigane;triiodoindigane

Drug info:

PubChemData

Smile

[CH3-].CC(C)O.CC(C)O.[CH2-]CCCOC1CCCCO1.[Ti+2]

DOS

IR

Vibrations