bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide

C74H166N8O2SSi6U2 — CID 139050380

IUPACbis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide
SMILESC1CCOC1.C1CCOC1.CC(C)[Si]([N-]CCN(CC[N-][Si](C(C)C)(C(C)C)C(C)C)CC[N-][Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C.CC(C)[Si]([N-]CCN(CC[N-][Si](C(C)C)(C(C)C)C(C)C)CC[N-][Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C.[S-2].[U+4].[U+4]
InChIInChI=1S/2C33H75N4Si3.2C4H8O.S.2U/c2*1-25(2)38(26(3)4,27(5)6)34-19-22-37(23-20-35-39(28(7)8,29(9)10)30(11)12)24-21-36-40(31(13)14,32(15)16)33(17)18;2*1-2-4-5-3-1;;;/h2*25-33H,19-24H2,1-18H3;2*1-4H2;;;/q2*-3;;;-2;2*+4
InChIKeyLMTUFVGDRIXVGG-UHFFFAOYSA-N
MW1876.84 g/mol
LogP25.46
Rot. Bonds42

About bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide

bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide (PubChem CID 139050380) has the molecular formula C74H166N8O2SSi6U2 and a molecular weight of 1876.84 g/mol. Its IUPAC name is bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide.

Molecular Properties

Compound Namebis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide
PubChem CID139050380
Molecular FormulaC74H166N8O2SSi6U2
Molecular Weight1876.84 g/mol
Exact Mass1875.25
IUPAC Namebis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide
SMILESC1CCOC1.C1CCOC1.CC(C)[Si]([N-]CCN(CC[N-][Si](C(C)C)(C(C)C)C(C)C)CC[N-][Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C.CC(C)[Si]([N-]CCN(CC[N-][Si](C(C)C)(C(C)C)C(C)C)CC[N-][Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C.[S-2].[U+4].[U+4]
InChIInChI=1S/2C33H75N4Si3.2C4H8O.S.2U/c2*1-25(2)38(26(3)4,27(5)6)34-19-22-37(23-20-35-39(28(7)8,29(9)10)30(11)12)24-21-36-40(31(13)14,32(15)16)33(17)18;2*1-2-4-5-3-1;;;/h2*25-33H,19-24H2,1-18H3;2*1-4H2;;;/q2*-3;;;-2;2*+4
InChIKeyLMTUFVGDRIXVGG-UHFFFAOYSA-N
XLogP25.46
TPSA109.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds42
Heavy Atoms93
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001876.84
LogP ≤ 525.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide?
The IUPAC name of bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide (CID 139050380) is bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide.
What is the SMILES notation for bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide?
The canonical SMILES for bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide is C1CCOC1.C1CCOC1.CC(C)[Si]([N-]CCN(CC[N-][Si](C(C)C)(C(C)C)C(C)C)CC[N-][Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C.CC(C)[Si]([N-]CCN(CC[N-][Si](C(C)C)(C(C)C)C(C)C)CC[N-][Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C.[S-2].[U+4].[U+4].
What is the InChIKey of bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide?
The InChIKey is LMTUFVGDRIXVGG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C33H75N4Si3.2C4H8O.S.2U/c2*1-25(2)38(26(3)4,27(5)6)34-19-22-37(23-20-35-39(28(7)8,29(9)10)30(11)12)24-21-36-40(31(13)14,32(15)16)33(17)18;2*1-2-4-5-3-1;;;/h2*25-33H,19-24H2,1-18H3;2*1-4H2;;;/q2*-3;;;-2;2*+4.
What are the key properties of bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide?
bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide has a molecular weight of 1876.84 g/mol, XLogP of 25.46, 42 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-[bis[2-tri(propan-2-yl)silylazanidylethyl]amino]ethyl-tri(propan-2-yl)silylazanide);oxolane;bis(uranium(4+));sulfide is sourced from PubChem (CID 139050380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).