methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+)

C21H21PSY+ — CID 20609775

IUPACmethanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+)
SMILES[CH2-]SC.[H][C-]=P(c1ccccc1)(c1ccccc1)c1ccccc1.[Y+3]
InChIInChI=1S/C19H16P.C2H5S.Y/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19;1-3-2;/h1-16H;1H2,2H3;/q2*-1;+3
InChIKeyAYXXVRXZXMMLKA-UHFFFAOYSA-N
MW425.35 g/mol
LogP4.43
Rot. Bonds3

About methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+)

methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+) (PubChem CID 20609775) has the molecular formula C21H21PSY+ and a molecular weight of 425.35 g/mol. Its IUPAC name is methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+).

Molecular Properties

Compound Namemethanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+)
PubChem CID20609775
Molecular FormulaC21H21PSY+
Molecular Weight425.35 g/mol
Exact Mass425.02
IUPAC Namemethanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+)
SMILES[CH2-]SC.[H][C-]=P(c1ccccc1)(c1ccccc1)c1ccccc1.[Y+3]
InChIInChI=1S/C19H16P.C2H5S.Y/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19;1-3-2;/h1-16H;1H2,2H3;/q2*-1;+3
InChIKeyAYXXVRXZXMMLKA-UHFFFAOYSA-N
XLogP4.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.35
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+)?
The IUPAC name of methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+) (CID 20609775) is methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+).
What is the SMILES notation for methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+)?
The canonical SMILES for methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+) is [CH2-]SC.[H][C-]=P(c1ccccc1)(c1ccccc1)c1ccccc1.[Y+3].
What is the InChIKey of methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+)?
The InChIKey is AYXXVRXZXMMLKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16P.C2H5S.Y/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19;1-3-2;/h1-16H;1H2,2H3;/q2*-1;+3.
What are the key properties of methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+)?
methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+) has a molecular weight of 425.35 g/mol, XLogP of 4.43, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanidylidene(triphenyl)-λ5-phosphane;methanidylsulfanylmethane;yttrium(3+) is sourced from PubChem (CID 20609775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).