dicalcium; bis(trimethylsilyl)azanium; oxolane; 2,2,6,6-tetramethylheptane-3,5-diolate

Systemtic Name: dicalcium; bis(trimethylsilyl)azanium; oxolane; 2,2,6,6-tetramethylheptane-3,5-diolate Openeye Name: dicalcium; bis(trimethylsilyl)ammonium; tetrahydrofuran; 2,2,6,6-tetramethylheptane-3,5-diolate CAS Name: dicalcium; bis(trimethylsilyl)ammonium; oxolane; 2,2,6,6-tetramethylheptane-3,5-diolate IUPAC Name: dicalcium; bis(trimethylsilyl)azanium; oxolane; 2,2,6,6-tetramethylheptane-3,5-diolate Traditional Name: dicalcium; bis(trimethylsilyl)ammonium; tetrahydrofuran; 2,2,6,6-tetramethylheptane-3,5-diolate Formula: C47H102Ca2NO8Si2- MolecularWeight: 945.64168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CC(C(C)(C)C)[O-])[O-].CC(C)(C)C(CC(C(C)(C)C)[O-])[O-].CC(C)(C)C(CC(C(C)(C)C)[O-])[O-].C[Si](C)(C)[NH2+][Si](C)(C)C.C1CCOC1.C1CCOC1.[Ca+2].[Ca+2]

Isomeric SMILES

CC(C)(C)C(CC(C(C)(C)C)[O-])[O-].CC(C)(C)C(CC(C(C)(C)C)[O-])[O-].CC(C)(C)C(CC(C(C)(C)C)[O-])[O-].C[Si](C)(C)[NH2+][Si](C)(C)C.C1CCOC1.C1CCOC1.[Ca+2].[Ca+2]

InChI

InChI=1S/3C11H22O2.C6H20NSi2.2C4H8O.2Ca/c3*1-10(2,3)8(12)7-9(13)11(4,5)6;1-8(2,3)7-9(4,5)6;2*1-2-4-5-3-1;;/h3*8-9H,7H2,1-6H3;7H2,1-6H3;2*1-4H2;;/q3*-2;+1;;;2*+2