bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium

C16H27Si2Sm-3 — CID 173206877

IUPACbis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium
SMILESC[Si](C)(C)C1=[C-]CC=C1.C[Si](C)(C)C1=[C-]CC=C1.[H-].[Sm]
InChIInChI=1S/2C8H13Si.Sm.H/c2*1-9(2,3)8-6-4-5-7-8;;/h2*4,6H,5H2,1-3H3;;/q2*-1;;-1
InChIKeyAROSGACORIGQKN-UHFFFAOYSA-N
MW425.92 g/mol
LogP5.22
Rot. Bonds2

About bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium

bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium (PubChem CID 173206877) has the molecular formula C16H27Si2Sm-3 and a molecular weight of 425.92 g/mol. Its IUPAC name is bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium.

Molecular Properties

Compound Namebis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium
PubChem CID173206877
Molecular FormulaC16H27Si2Sm-3
Molecular Weight425.92 g/mol
Exact Mass427.09
IUPAC Namebis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium
SMILESC[Si](C)(C)C1=[C-]CC=C1.C[Si](C)(C)C1=[C-]CC=C1.[H-].[Sm]
InChIInChI=1S/2C8H13Si.Sm.H/c2*1-9(2,3)8-6-4-5-7-8;;/h2*4,6H,5H2,1-3H3;;/q2*-1;;-1
InChIKeyAROSGACORIGQKN-UHFFFAOYSA-N
XLogP5.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.92
LogP ≤ 55.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

cyclopenta-1,4-dien-1-yl(trimethyl)silane;ruthenium(1+)
CID 174573156
bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);nickel(2+)
CID 140556660
bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);zirconium(4+);dichloride
CID 57351468
bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);phenylmethylbenzene;zirconium(3+)
CID 174985853
cyclopenta-1,4-dien-1-yl(trimethyl)silane;9H-fluoren-9-ide;zirconium(2+)
CID 174666517
lithium tert-butyl-cyclopenta-1,4-dien-1-yl-dimethylsilane
CID 18347364
bis(N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]-N-methylmethanamine);hafnium(4+);dichloride
CID 87839436
CID 173068187
CID 173068187
tert-butyl-cyclopenta-1,4-dien-1-yl-dimethylsilane;zirconium;dihydrochloride
CID 87316415
cyclopenta-1,4-dien-1-yl-methoxy-dimethylsilane;titanium(3+);dichloride
CID 87976705
cyclopenta-1,4-dien-1-yl(trimethyl)silane;methylidenetitanium(1+);3-methyl-5-trimethylsilylphenol
CID 87496612
bis(cyclopenta-1,4-dien-1-yl(triethyl)silane);molybdenum(2+)
CID 175066339

Frequently Asked Questions

What is the IUPAC name of bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium?
The IUPAC name of bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium (CID 173206877) is bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium.
What is the SMILES notation for bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium?
The canonical SMILES for bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium is C[Si](C)(C)C1=[C-]CC=C1.C[Si](C)(C)C1=[C-]CC=C1.[H-].[Sm].
What is the InChIKey of bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium?
The InChIKey is AROSGACORIGQKN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H13Si.Sm.H/c2*1-9(2,3)8-6-4-5-7-8;;/h2*4,6H,5H2,1-3H3;;/q2*-1;;-1.
What are the key properties of bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium?
bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium has a molecular weight of 425.92 g/mol, XLogP of 5.22, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hydride;samarium is sourced from PubChem (CID 173206877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).