bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane

C80H98N6O2P4Pb2Si4 — CID 139150031

IUPACbis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane
SMILESC1CCOC1.C1CCOC1.C[Si](C)(C)N=P(c1ccccc1)(c1ccccc1)c1cccc([C-]=P([N-][Si](C)(C)C)(c2ccccc2)c2ccccc2)n1.C[Si](C)(C)N=P(c1ccccc1)(c1ccccc1)c1cccc([C-]=P([N-][Si](C)(C)C)(c2ccccc2)c2ccccc2)n1.[Pb+2].[Pb+2]
InChIInChI=1S/2C36H41N3P2Si2.2C4H8O.2Pb/c2*1-42(2,3)38-40(32-21-11-7-12-22-32,33-23-13-8-14-24-33)30-31-20-19-29-36(37-31)41(39-43(4,5)6,34-25-15-9-16-26-34)35-27-17-10-18-28-35;2*1-2-4-5-3-1;;/h2*7-29H,1-6H3;2*1-4H2;;/q2*-2;;;2*+2
InChIKeyKJPAMIRNZAPQRL-UHFFFAOYSA-N
MW1826.34 g/mol
LogP17.26
Rot. Bonds18

About bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane

bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane (PubChem CID 139150031) has the molecular formula C80H98N6O2P4Pb2Si4 and a molecular weight of 1826.34 g/mol. Its IUPAC name is bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane.

Molecular Properties

Compound Namebis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane
PubChem CID139150031
Molecular FormulaC80H98N6O2P4Pb2Si4
Molecular Weight1826.34 g/mol
Exact Mass1826.53
IUPAC Namebis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane
SMILESC1CCOC1.C1CCOC1.C[Si](C)(C)N=P(c1ccccc1)(c1ccccc1)c1cccc([C-]=P([N-][Si](C)(C)C)(c2ccccc2)c2ccccc2)n1.C[Si](C)(C)N=P(c1ccccc1)(c1ccccc1)c1cccc([C-]=P([N-][Si](C)(C)C)(c2ccccc2)c2ccccc2)n1.[Pb+2].[Pb+2]
InChIInChI=1S/2C36H41N3P2Si2.2C4H8O.2Pb/c2*1-42(2,3)38-40(32-21-11-7-12-22-32,33-23-13-8-14-24-33)30-31-20-19-29-36(37-31)41(39-43(4,5)6,34-25-15-9-16-26-34)35-27-17-10-18-28-35;2*1-2-4-5-3-1;;/h2*7-29H,1-6H3;2*1-4H2;;/q2*-2;;;2*+2
InChIKeyKJPAMIRNZAPQRL-UHFFFAOYSA-N
XLogP17.26
TPSA97.16 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds18
Heavy Atoms98
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001826.34
LogP ≤ 517.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane?
The IUPAC name of bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane (CID 139150031) is bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane.
What is the SMILES notation for bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane?
The canonical SMILES for bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane is C1CCOC1.C1CCOC1.C[Si](C)(C)N=P(c1ccccc1)(c1ccccc1)c1cccc([C-]=P([N-][Si](C)(C)C)(c2ccccc2)c2ccccc2)n1.C[Si](C)(C)N=P(c1ccccc1)(c1ccccc1)c1cccc([C-]=P([N-][Si](C)(C)C)(c2ccccc2)c2ccccc2)n1.[Pb+2].[Pb+2].
What is the InChIKey of bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane?
The InChIKey is KJPAMIRNZAPQRL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C36H41N3P2Si2.2C4H8O.2Pb/c2*1-42(2,3)38-40(32-21-11-7-12-22-32,33-23-13-8-14-24-33)30-31-20-19-29-36(37-31)41(39-43(4,5)6,34-25-15-9-16-26-34)35-27-17-10-18-28-35;2*1-2-4-5-3-1;;/h2*7-29H,1-6H3;2*1-4H2;;/q2*-2;;;2*+2.
What are the key properties of bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane?
bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane has a molecular weight of 1826.34 g/mol, XLogP of 17.26, 18 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis([[6-[diphenyl(trimethylsilylimino)-λ5-phosphanyl]-2-pyridinyl]methylidene-diphenyl-λ5-phosphanyl]-trimethylsilylazanide);bis(lead(2+));oxolane is sourced from PubChem (CID 139150031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).