but-2-ene;carbanide;niobium(2+)

C5H10Nb — CID 22086726

IUPACbut-2-ene;carbanide;niobium(2+)
SMILESC/[C-]=C\C.[CH3-].[Nb+2]
InChIInChI=1S/C4H7.CH3.Nb/c1-3-4-2;;/h3H,1-2H3;1H3;/q2*-1;+2
InChIKeyRGKBBOISMWHGRP-UHFFFAOYSA-N
MW163.04 g/mol
LogP1.83
Rot. Bonds

About but-2-ene;carbanide;niobium(2+)

but-2-ene;carbanide;niobium(2+) (PubChem CID 22086726) has the molecular formula C5H10Nb and a molecular weight of 163.04 g/mol. Its IUPAC name is but-2-ene;carbanide;niobium(2+).

Molecular Properties

Compound Namebut-2-ene;carbanide;niobium(2+)
PubChem CID22086726
Molecular FormulaC5H10Nb
Molecular Weight163.04 g/mol
Exact Mass162.98
IUPAC Namebut-2-ene;carbanide;niobium(2+)
SMILESC/[C-]=C\C.[CH3-].[Nb+2]
InChIInChI=1S/C4H7.CH3.Nb/c1-3-4-2;;/h3H,1-2H3;1H3;/q2*-1;+2
InChIKeyRGKBBOISMWHGRP-UHFFFAOYSA-N
XLogP1.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.04
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of but-2-ene;carbanide;niobium(2+)?
The IUPAC name of but-2-ene;carbanide;niobium(2+) (CID 22086726) is but-2-ene;carbanide;niobium(2+).
What is the SMILES notation for but-2-ene;carbanide;niobium(2+)?
The canonical SMILES for but-2-ene;carbanide;niobium(2+) is C/[C-]=C\C.[CH3-].[Nb+2].
What is the InChIKey of but-2-ene;carbanide;niobium(2+)?
The InChIKey is RGKBBOISMWHGRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7.CH3.Nb/c1-3-4-2;;/h3H,1-2H3;1H3;/q2*-1;+2.
What are the key properties of but-2-ene;carbanide;niobium(2+)?
but-2-ene;carbanide;niobium(2+) has a molecular weight of 163.04 g/mol, XLogP of 1.83, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for but-2-ene;carbanide;niobium(2+) is sourced from PubChem (CID 22086726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).