chloranyl(diethyl)alumane; neodymium(3+); octanoate; pentane-2,4-dione; triethylalumane

Systemtic Name: chloranyl(diethyl)alumane; neodymium(3+); octanoate; pentane-2,4-dione; triethylalumane Openeye Name: chloro(diethyl)alumane; neodymium(3+); octanoate; pentane-2,4-dione; triethylalumane CAS Name: chloro(diethyl)alumane; neodymium(3+); octanoate; pentane-2,4-dione; triethylalumane IUPAC Name: chloro(diethyl)alumane; neodymium(3+); octanoate; pentane-2,4-dione; triethylalumane Traditional Name: caprylate; chloro(diethyl)alumane; neodymium(3+); pentane-2,4-dione; triethylalumane Formula: C57H114Al4Cl3NdO12 MolecularWeight: 1350.033012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].CC[Al](CC)CC.CC[Al](CC)Cl.CC[Al](CC)Cl.CC[Al](CC)Cl.CC(=O)CC(=O)C.CC(=O)CC(=O)C.CC(=O)CC(=O)C.[Nd+3]

Isomeric SMILES

CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].CC[Al](CC)CC.CC[Al](CC)Cl.CC[Al](CC)Cl.CC[Al](CC)Cl.CC(=O)CC(=O)C.CC(=O)CC(=O)C.CC(=O)CC(=O)C.[Nd+3]

InChI

InChI=1S/3C8H16O2.3C5H8O2.9C2H5.4Al.3ClH.Nd/c3*1-2-3-4-5-6-7-8(9)10;3*1-4(6)3-5(2)7;9*1-2;;;;;;;;/h3*2-7H2,1H3,(H,9,10);3*3H2,1-2H3;9*1H2,2H3;;;;;3*1H;/q;;;;;;;;;;;;;;;;3*+1;;;;+3/p-6