# Species Formula 6039 DiiodosilaneH2SiI2 6040 C2PI (GUTJOU) (Geo)C10H6P2I2 6041 Potassium iodide, dimer (Geo)K2I2 6042 Potassium iodide, dimerK2I2 6043 Calcium diiodide (Geo)CaI2 6044 Calcium diiodideCaI2 6045 Ca(II)N4I2 (TAQQEH) (Geo)C20H16N4CaI2 6046 Ca(II)N4I2 (TAQQEH)C20H16N4CaI2 6047 Ca(II)N5I2 (TANQOO) (Geo)C10H15N5CaI2 6048 Ca(II)N5I2 (TANQOO)C10H15N5CaI2 6049 Titanium diiodide TiI2 6050 Ti(III)I2N4(+) (KADVIU) (Geo)C8H12N4TiI2 6051 Titanium(IV) oxide diiodide (Geo)OTiI2 6052 Titanium(IV) oxide diiodideOTiI2 6053 Cr(III)CpI2 (Geo)C5H5CrI2 6054 Cr(III)CpI2C5H5CrI2 6055 Chromium(VI) diiodide dioxideO2CrI2 6056 Chromium(VI) diiodide dioxide (Geo)O2CrI2 6057 Manganese(IV) oxide diiodideOMnI2 6058 Manganese(IV) oxide diiodide (Geo)OMnI2 6059 Mn(II)(H2O)4I2(trans)H8O4MnI2
SHIFT=10 UHF TRIPLET SYMMETRY PM7 Titanium diiodide H=-4.7 HR=NIST I 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 Ti 2.68538856 +1 0.0000000 +0 0.0000000 +0 1 0 0 I 2.68538856 +0 179.9321895 +1 180.0000000 +0 2 1 0