Compound Summary for: CID 24199707

Molecular Formula: C10H2Mn-10   Molecular Weight: 177.060925   InChIKey: HDTBMGOTBXMORT-UHFFFAOYSA-N
Compound Information
CID 24199707
Create Date: 2008-02-29
Deprecated compound

No substance information
Properties and Descriptors
Properties
Molecular Weight 177.060925 [g/mol]
Molecular FormulaC10H2Mn-10
H-Bond Donor0
H-Bond Acceptor10
Rotatable Bond Count0
Exact Mass176.953695
MonoIsotopic Mass176.953695
Topological Polar Surface Area0
Heavy Atom Count11
Formal Charge-10
Complexity58.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Descriptors
IUPAC Namecyclopenta-1,3-diene;manganese
InChIInChI=1S/2C5H.Mn/c2*1-2-4-5-3-1;/h2*1H;/q2*-5;
InChIKeyHDTBMGOTBXMORT-UHFFFAOYSA-N
Canonical SMILES[CH-]1[C-]=[C-][C-]=[C-]1.[CH-]1[C-]=[C-][C-]=[C-]1.[Mn]
Isomeric SMILES[CH-]1[C-]=[C-][C-]=[C-]1.[CH-]1[C-]=[C-][C-]=[C-]1.[Mn]