dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc

CdO2S2TiZn — CID 174808132

IUPACdioxotitanium;sulfanylidenecadmium;sulfanylidenezinc
SMILESO=[Ti]=O.S=[Cd].S=[Zn]
InChIInChI=1S/Cd.2O.2S.Ti.Zn
InChIKeyTWFHFTHMQAWTSS-UHFFFAOYSA-N
MW321.80 g/mol
LogP1.05
Rot. Bonds

About dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc

dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc (PubChem CID 174808132) has the molecular formula CdO2S2TiZn and a molecular weight of 321.80 g/mol. Its IUPAC name is dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc.

Molecular Properties

Compound Namedioxotitanium;sulfanylidenecadmium;sulfanylidenezinc
PubChem CID174808132
Molecular FormulaCdO2S2TiZn
Molecular Weight321.80 g/mol
Exact Mass321.71
IUPAC Namedioxotitanium;sulfanylidenecadmium;sulfanylidenezinc
SMILESO=[Ti]=O.S=[Cd].S=[Zn]
InChIInChI=1S/Cd.2O.2S.Ti.Zn
InChIKeyTWFHFTHMQAWTSS-UHFFFAOYSA-N
XLogP1.05
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.80
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dioxotitanium;λ2-plumbane
CID 173108589
magnesium;hydride;sulfanylidenecopper
CID 174389841
dioxotitanium;tellane
CID 174815951
dioxotitanium;praseodymium
CID 174593167
dioxotitanium;scandium
CID 174678870
dioxotitanium;vanadium
CID 174292622
dioxotitanium;oxoiron;oxozinc
CID 173077578
sulfanylidenecopper
CID 14831
sulfanylidenecopper;sulfanylidenezinc
CID 173435910
dioxotitanium;oxovanadium
CID 173420132
sodium;dioxotitanium;chloride
CID 173342145
cobalt;dioxotitanium;manganese
CID 173118958

Frequently Asked Questions

What is the IUPAC name of dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc?
The IUPAC name of dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc (CID 174808132) is dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc.
What is the SMILES notation for dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc?
The canonical SMILES for dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc is O=[Ti]=O.S=[Cd].S=[Zn].
What is the InChIKey of dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc?
The InChIKey is TWFHFTHMQAWTSS-UHFFFAOYSA-N. The full InChI is InChI=1S/Cd.2O.2S.Ti.Zn.
What are the key properties of dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc?
dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc has a molecular weight of 321.80 g/mol, XLogP of 1.05, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dioxotitanium;sulfanylidenecadmium;sulfanylidenezinc is sourced from PubChem (CID 174808132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).