lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene

C128H146BrCl3LiSi6Zr+ — CID 162267523

About lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene

lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene (PubChem CID 162267523) has the molecular formula C128H146BrCl3LiSi6Zr+ and a molecular weight of 2137.52 g/mol. Its IUPAC name is lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene.

Molecular Properties

• Compound Name: lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene
• PubChem CID: 162267523
• Molecular Formula: C128H146BrCl3LiSi6Zr+
• Molecular Weight: 2137.52 g/mol
• Exact Mass: 2131.75
• IUPAC Name: lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene
• SMILES: Brc1cccc2c1CC=C2.C1=Cc2cccc(-c3cccc4ccccc34)c2C1.C[Si](C)(C1C=CC=C1)[Si](C)(C)C1C=Cc2c(-c3cccc4ccccc34)cccc21.C[Si](C)(C1CCCC1)[Si](C)(C)C1CCC2C(c3cccc4ccccc34)CCCC21.C[Si](C)(Cl)[Si](C)(C)C1C=Cc2c(-c3cccc4ccccc34)cccc21.Cl[Zr+2]Cl.[CH3-].[CH3-].[Li+].c1ccc2c(C3CCCC4CCCC43)cccc2c1
• InChI: InChI=1S/C28H42Si2.C28H30Si2.C23H25ClSi2.C19H22.C19H14.C9H7Br.2CH3.2ClH.Li.Zr/c2*1-29(2,22-13-6-7-14-22)30(3,4)28-20-19-26-25(17-10-18-27(26)28)24-16-9-12-21-11-5-8-15-23(21)24;1-25(2,26(3,4)24)23-16-15-21-20(13-8-14-22(21)23)19-12-7-10-17-9-5-6-11-18(17)19;2*1-2-10-16-14(6-1)8-4-12-18(16)19-13-5-9-15-7-3-11-17(15)19;10-9-6-2-4-7-3-1-5-8(7)9;;;;;;/h5,8-9,11-12,15-16,22,25-28H,6-7,10,13-14,17-20H2,1-4H3;5-20,22,28H,1-4H3;5-16,23H,1-4H3;1-2,4,6,8,10,12,15,17,19H,3,5,7,9,11,13H2;1-10,12-13H,11H2;1-4,6H,5H2;2*1H3;2*1H;;/q;;;;;;2*-1;;;+1;+4/p-2
• InChIKey: DEWOCVCPWIQAIE-UHFFFAOYSA-L
• XLogP: 37.38
• TPSA: 0.00 Ų
• Rotatable Bonds: 13
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2137.52
LogP ≤ 5	37.38
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene?

The IUPAC name of lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene (CID 162267523) is lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene.

What is the SMILES notation for lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene?

The canonical SMILES for lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene is Brc1cccc2c1CC=C2.C1=Cc2cccc(-c3cccc4ccccc34)c2C1.C[Si](C)(C1C=CC=C1)[Si](C)(C)C1C=Cc2c(-c3cccc4ccccc34)cccc21.C[Si](C)(C1CCCC1)[Si](C)(C)C1CCC2C(c3cccc4ccccc34)CCCC21.C[Si](C)(Cl)[Si](C)(C)C1C=Cc2c(-c3cccc4ccccc34)cccc21.Cl[Zr+2]Cl.[CH3-].[CH3-].[Li+].c1ccc2c(C3CCCC4CCCC43)cccc2c1.

What is the InChIKey of lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene?

The InChIKey is DEWOCVCPWIQAIE-UHFFFAOYSA-L. The full InChI is InChI=1S/C28H42Si2.C28H30Si2.C23H25ClSi2.C19H22.C19H14.C9H7Br.2CH3.2ClH.Li.Zr/c2*1-29(2,22-13-6-7-14-22)30(3,4)28-20-19-26-25(17-10-18-27(26)28)24-16-9-12-21-11-5-8-15-23(21)24;1-25(2,26(3,4)24)23-16-15-21-20(13-8-14-22(21)23)19-12-7-10-17-9-5-6-11-18(17)19;2*1-2-10-16-14(6-1)8-4-12-18(16)19-13-5-9-15-7-3-11-17(15)19;10-9-6-2-4-7-3-1-5-8(7)9;;;;;;/h5,8-9,11-12,15-16,22,25-28H,6-7,10,13-14,17-20H2,1-4H3;5-20,22,28H,1-4H3;5-16,23H,1-4H3;1-2,4,6,8,10,12,15,17,19H,3,5,7,9,11,13H2;1-10,12-13H,11H2;1-4,6H,5H2;2*1H3;2*1H;;/q;;;;;;2*-1;;;+1;+4/p-2.

What are the key properties of lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene?

lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene has a molecular weight of 2137.52 g/mol, XLogP of 37.38, 13 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for lithium;1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl)naphthalene;7-bromo-1H-indene;carbanide;chloro-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopenta-2,4-dien-1-yl-[dimethyl-(4-naphthalen-1-yl-1H-inden-1-yl)silyl]-dimethylsilane;cyclopentyl-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;dichlorozirconium(2+);1-(3H-inden-4-yl)naphthalene is sourced from PubChem (CID 162267523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).