carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide)

C41H31Au2F10P2-2 — CID 134901244

IUPACcarbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide)
SMILESFc1[c-]c(F)c(F)c(F)c1F.Fc1[c-]c(F)c(F)c(F)c1F.[Au+3].[Au].[CH2-][P+]([CH2-])(c1ccccc1)c1ccccc1.[CH2-][P+]([CH2-])(c1ccccc1)c1ccccc1.[CH3-]
InChIInChI=1S/2C14H14P.2C6F5.CH3.2Au/c2*1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14;2*7-2-1-3(8)5(10)6(11)4(2)9;;;/h2*3-12H,1-2H2;;;1H3;;/q5*-1;;+3
InChIKeyFPKZHRFLBXEUPK-UHFFFAOYSA-N
MW1169.56 g/mol
LogP11.29
Rot. Bonds4

About carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide)

carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide) (PubChem CID 134901244) has the molecular formula C41H31Au2F10P2-2 and a molecular weight of 1169.56 g/mol. Its IUPAC name is carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide).

Molecular Properties

Compound Namecarbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide)
PubChem CID134901244
Molecular FormulaC41H31Au2F10P2-2
Molecular Weight1169.56 g/mol
Exact Mass1169.11
IUPAC Namecarbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide)
SMILESFc1[c-]c(F)c(F)c(F)c1F.Fc1[c-]c(F)c(F)c(F)c1F.[Au+3].[Au].[CH2-][P+]([CH2-])(c1ccccc1)c1ccccc1.[CH2-][P+]([CH2-])(c1ccccc1)c1ccccc1.[CH3-]
InChIInChI=1S/2C14H14P.2C6F5.CH3.2Au/c2*1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14;2*7-2-1-3(8)5(10)6(11)4(2)9;;;/h2*3-12H,1-2H2;;;1H3;;/q5*-1;;+3
InChIKeyFPKZHRFLBXEUPK-UHFFFAOYSA-N
XLogP11.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001169.56
LogP ≤ 511.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

[dimethanidyl(diphenyl)-λ5-phosphanyl] acetate;dimethanidyl(diphenyl)phosphanium;gold;1,2,3,4,5-pentafluorobenzene-6-ide
CID 134901330
[dimethanidyl(diphenyl)-λ5-phosphanyl] perchlorate;dimethanidyl(diphenyl)phosphanium;gold;1,2,3,4,5-pentafluorobenzene-6-ide;triphenylarsane
CID 134901255
nickel;1,2,3,4,5-pentafluorobenzene-6-ide;toluene
CID 87365885
carbon monoxide;iridium;1,2,3,4,5-pentafluorobenzene-6-ide;bis(triphenylphosphane)
CID 135047757
carbanide;1,2,3,4,5-pentafluorobenzene-6-ide;yttrium
CID 59920259
CID 135082204
CID 135082204
carbanide;dimethanidyl(diphenyl)phosphanium;gold;iodo-dimethanidyl-diphenyl-λ5-phosphane
CID 134889957
azanide;molybdenum;1,2,3,4,5-pentafluorobenzene-6-ide
CID 175473652
[dimethanidyl(diphenyl)-λ5-phosphanyl] perchlorate;dimethanidyl(diphenyl)phosphanium;gold;1,3,5-trifluorobenzene-6-ide
CID 134901253
acetonitrile;bromo-dimethanidyl-diphenyl-λ5-phosphane;dimethanidyl(diphenyl)phosphanium;gold
CID 134901334
chloroplatinum(1+);(8E,23E)-1,16-diphenyl-1,16-diphosphacyclotriaconta-8,23-diene;1,2,3,4,5-pentafluorobenzene-6-ide
CID 11320642
bromo-dimethanidyl-diphenyl-λ5-phosphane;dimethanidyl(diphenyl)phosphanium;gold;1-phenylethanone
CID 134901974

Frequently Asked Questions

What is the IUPAC name of carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide)?
The IUPAC name of carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide) (CID 134901244) is carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide).
What is the SMILES notation for carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide)?
The canonical SMILES for carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide) is Fc1[c-]c(F)c(F)c(F)c1F.Fc1[c-]c(F)c(F)c(F)c1F.[Au+3].[Au].[CH2-][P+]([CH2-])(c1ccccc1)c1ccccc1.[CH2-][P+]([CH2-])(c1ccccc1)c1ccccc1.[CH3-].
What is the InChIKey of carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide)?
The InChIKey is FPKZHRFLBXEUPK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H14P.2C6F5.CH3.2Au/c2*1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14;2*7-2-1-3(8)5(10)6(11)4(2)9;;;/h2*3-12H,1-2H2;;;1H3;;/q5*-1;;+3.
What are the key properties of carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide)?
carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide) has a molecular weight of 1169.56 g/mol, XLogP of 11.29, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;bis(dimethanidyl(diphenyl)phosphanium);gold;gold(3+);bis(1,2,3,4,5-pentafluorobenzene-6-ide) is sourced from PubChem (CID 134901244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).