methane;sulfanylidenevanadium;(vanadium)

C3H12SV40 — CID 158198901

IUPACmethane;sulfanylidenevanadium;(vanadium)
SMILESC.C.C.S=[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V]
InChIInChI=1S/3CH4.S.40V/h3*1H4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyCVWYMKSVXWNOBQ-UHFFFAOYSA-N
MW2117.96 g/mol
LogP2.46
Rot. Bonds

About methane;sulfanylidenevanadium;(vanadium)

methane;sulfanylidenevanadium;(vanadium) (PubChem CID 158198901) has the molecular formula C3H12SV40 and a molecular weight of 2117.96 g/mol. Its IUPAC name is methane;sulfanylidenevanadium;(vanadium).

Molecular Properties

Compound Namemethane;sulfanylidenevanadium;(vanadium)
PubChem CID158198901
Molecular FormulaC3H12SV40
Molecular Weight2117.96 g/mol
Exact Mass2117.82
IUPAC Namemethane;sulfanylidenevanadium;(vanadium)
SMILESC.C.C.S=[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V]
InChIInChI=1S/3CH4.S.40V/h3*1H4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyCVWYMKSVXWNOBQ-UHFFFAOYSA-N
XLogP2.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms44
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 5002117.96
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of methane;sulfanylidenevanadium;(vanadium)?
The IUPAC name of methane;sulfanylidenevanadium;(vanadium) (CID 158198901) is methane;sulfanylidenevanadium;(vanadium).
What is the SMILES notation for methane;sulfanylidenevanadium;(vanadium)?
The canonical SMILES for methane;sulfanylidenevanadium;(vanadium) is C.C.C.S=[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].
What is the InChIKey of methane;sulfanylidenevanadium;(vanadium)?
The InChIKey is CVWYMKSVXWNOBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/3CH4.S.40V/h3*1H4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;.
What are the key properties of methane;sulfanylidenevanadium;(vanadium)?
methane;sulfanylidenevanadium;(vanadium) has a molecular weight of 2117.96 g/mol, XLogP of 2.46, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;sulfanylidenevanadium;(vanadium) is sourced from PubChem (CID 158198901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).