disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate

C30H48Ag2F12N8P2 — CID 139197470

IUPACdisilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate
SMILESCC[n+]1[c-]n(CCCCCn2[c-][n+](CC)cc2)cc1.CC[n+]1[c-]n(CCCCCn2[c-][n+](CC)cc2)cc1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Ag+].[Ag+]
InChIInChI=1S/2C15H24N4.2Ag.2F6P/c2*1-3-16-10-12-18(14-16)8-6-5-7-9-19-13-11-17(4-2)15-19;;;2*1-7(2,3,4,5)6/h2*10-13H,3-9H2,1-2H3;;;;/q;;2*+1;2*-1
InChIKeyGQKRXGHOWOUVEZ-UHFFFAOYSA-N
MW1026.43 g/mol
LogP9.51
Rot. Bonds16

About disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate

disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate (PubChem CID 139197470) has the molecular formula C30H48Ag2F12N8P2 and a molecular weight of 1026.43 g/mol. Its IUPAC name is disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate.

Molecular Properties

Compound Namedisilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate
PubChem CID139197470
Molecular FormulaC30H48Ag2F12N8P2
Molecular Weight1026.43 g/mol
Exact Mass1024.14
IUPAC Namedisilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate
SMILESCC[n+]1[c-]n(CCCCCn2[c-][n+](CC)cc2)cc1.CC[n+]1[c-]n(CCCCCn2[c-][n+](CC)cc2)cc1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Ag+].[Ag+]
InChIInChI=1S/2C15H24N4.2Ag.2F6P/c2*1-3-16-10-12-18(14-16)8-6-5-7-9-19-13-11-17(4-2)15-19;;;2*1-7(2,3,4,5)6/h2*10-13H,3-9H2,1-2H3;;;;/q;;2*+1;2*-1
InChIKeyGQKRXGHOWOUVEZ-UHFFFAOYSA-N
XLogP9.51
TPSA35.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001026.43
LogP ≤ 59.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate?
The IUPAC name of disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate (CID 139197470) is disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate.
What is the SMILES notation for disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate?
The canonical SMILES for disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate is CC[n+]1[c-]n(CCCCCn2[c-][n+](CC)cc2)cc1.CC[n+]1[c-]n(CCCCCn2[c-][n+](CC)cc2)cc1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Ag+].[Ag+].
What is the InChIKey of disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate?
The InChIKey is GQKRXGHOWOUVEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H24N4.2Ag.2F6P/c2*1-3-16-10-12-18(14-16)8-6-5-7-9-19-13-11-17(4-2)15-19;;;2*1-7(2,3,4,5)6/h2*10-13H,3-9H2,1-2H3;;;;/q;;2*+1;2*-1.
What are the key properties of disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate?
disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate has a molecular weight of 1026.43 g/mol, XLogP of 9.51, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate is sourced from PubChem (CID 139197470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).