Compound Summary for: CID 6352

Molecular Formula: C2Ca   Molecular Weight: 64.0994   InChIKey: UIXRSLJINYRGFQ-UHFFFAOYSA-N
Compound Information
CID 6352
Create Date: 2005-08-08
Suppressed Compound
Properties and Descriptors
Properties
Molecular Weight 64.0994 [g/mol]
Molecular FormulaC2Ca
H-Bond Donor0
H-Bond Acceptor2
Rotatable Bond Count0
Exact Mass63.962591
MonoIsotopic Mass63.962591
Topological Polar Surface Area0
Heavy Atom Count3
Formal Charge0
Complexity8
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Descriptors
IUPAC Namecalcium;acetylide
InChIInChI=1S/C2.Ca/c1-2;/q-2;+2
InChIKeyUIXRSLJINYRGFQ-UHFFFAOYSA-N
Canonical SMILES[C-]#[C-].[Ca+2]
Isomeric SMILES[C-]#[C-].[Ca+2]
Old Version Substance Information