magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate)

C74H50Cl6Er2MgN8O8 — CID 139170866

IUPACmagnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate)
SMILESClC(Cl)Cl.ClC(Cl)Cl.[Er+3].[Er+3].[Mg+2].[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12
InChIInChI=1S/8C9H7NO.2CHCl3.2Er.Mg/c8*11-8-5-1-3-7-4-2-6-10-9(7)8;2*2-1(3)4;;;/h8*1-6,11H;2*1H;;;/q;;;;;;;;;;2*+3;+2/p-8
InChIKeyFDLSZZMXNYTYRD-UHFFFAOYSA-F
MW1750.80 g/mol
LogP14.06
Rot. Bonds

About magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate)

magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate) (PubChem CID 139170866) has the molecular formula C74H50Cl6Er2MgN8O8 and a molecular weight of 1750.80 g/mol. Its IUPAC name is magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate).

Molecular Properties

Compound Namemagnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate)
PubChem CID139170866
Molecular FormulaC74H50Cl6Er2MgN8O8
Molecular Weight1750.80 g/mol
Exact Mass1744.03
IUPAC Namemagnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate)
SMILESClC(Cl)Cl.ClC(Cl)Cl.[Er+3].[Er+3].[Mg+2].[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12
InChIInChI=1S/8C9H7NO.2CHCl3.2Er.Mg/c8*11-8-5-1-3-7-4-2-6-10-9(7)8;2*2-1(3)4;;;/h8*1-6,11H;2*1H;;;/q;;;;;;;;;;2*+3;+2/p-8
InChIKeyFDLSZZMXNYTYRD-UHFFFAOYSA-F
XLogP14.06
TPSA287.60 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds
Heavy Atoms99
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001750.80
LogP ≤ 514.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

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Related Compounds

Tetrakis(quinolin-8-olate);zirconium(4+)
CID 139195714
Tris(8-hydroxyquinolinato-kappa^2^O,N)oxoniobium(V) dichloromethane disolvate
CID 139066412
Oxotris(quinolin-8-olato-kappa^2^O,N)tantalum(V) dichloromethane disolvate
CID 139067917
Methoxyoxobis(quinolin-8-olato-kappa^2^N,O)vanadium(V)
CID 139071859
Bis(acetato-kappaO)bis(mu~3~-quinolin-8-olato-kappa^4^N,O:O:O)tetrakis(mu~2~-quinolin-8-olato-kappa^3^N,O:O)tetrazinc(II) dihydrate
CID 139076884
Tetrakis(quinolin-8-olato-kappa^2^N,O)hafnium(IV) toluene disolvate
CID 139077805
1,1-bis[kappa-O,N-(8-oxyquinolinato)]silacyclohexane
CID 139102092
Dizinc;bis(2-[[bis(pyridin-2-ylmethyl)amino]methyl]quinolin-8-olate);diperchlorate
CID 139127859
Tetrakis(manganese(2+));hexakis(2-(pyridin-2-ylmethylideneamino)phenolate);diperchlorate
CID 139129268
Hexakis(2-methylquinolin-8-olate);tris(palladium(2+))
CID 139145173
1,2-Dimethoxyethane;hexakis(quinolin-8-olate);bis(scandium(3+))
CID 139156738
bis(dichloromethane);tetrakis(dysprosium(3+));tetrakis((Z)-4-oxopent-2-en-2-olate);hexakis(quinolin-8-olate);dihydroxide
CID 139167797

Frequently Asked Questions

What is the IUPAC name of magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate)?
The IUPAC name of magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate) (CID 139170866) is magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate).
What is the SMILES notation for magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate)?
The canonical SMILES for magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate) is ClC(Cl)Cl.ClC(Cl)Cl.[Er+3].[Er+3].[Mg+2].[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.
What is the InChIKey of magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate)?
The InChIKey is FDLSZZMXNYTYRD-UHFFFAOYSA-F. The full InChI is InChI=1S/8C9H7NO.2CHCl3.2Er.Mg/c8*11-8-5-1-3-7-4-2-6-10-9(7)8;2*2-1(3)4;;;/h8*1-6,11H;2*1H;;;/q;;;;;;;;;;2*+3;+2/p-8.
What are the key properties of magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate)?
magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate) has a molecular weight of 1750.80 g/mol, XLogP of 14.06, 0 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;chloroform;bis(erbium(3+));octakis(quinolin-8-olate) is sourced from PubChem (CID 139170866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).