CID 175865438

CH4LiNiO — CID 175865438

IUPAC—
SMILESC.O=[Ni].[Li]
InChIInChI=1S/CH4.Li.Ni.O/h1H4;;;
InChIKeyMHTKDWPUQSSKTD-UHFFFAOYSA-N
MW97.68 g/mol
LogP0.13
Rot. Bonds

About CID 175865438

CID 175865438 (PubChem CID 175865438) has the molecular formula CH4LiNiO and a molecular weight of 97.68 g/mol.

Molecular Properties

Compound NameCID 175865438
PubChem CID175865438
Molecular FormulaCH4LiNiO
Molecular Weight97.68 g/mol
Exact Mass96.98
IUPAC Name—
SMILESC.O=[Ni].[Li]
InChIInChI=1S/CH4.Li.Ni.O/h1H4;;;
InChIKeyMHTKDWPUQSSKTD-UHFFFAOYSA-N
XLogP0.13
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.68
LogP ≤ 50.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 175865438?
The IUPAC name of CID 175865438 (CID 175865438) is not available.
What is the SMILES notation for CID 175865438?
The canonical SMILES for CID 175865438 is C.O=[Ni].[Li].
What is the InChIKey of CID 175865438?
The InChIKey is MHTKDWPUQSSKTD-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4.Li.Ni.O/h1H4;;;.
What are the key properties of CID 175865438?
CID 175865438 has a molecular weight of 97.68 g/mol, XLogP of 0.13, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175865438 is sourced from PubChem (CID 175865438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).