CID 592419
PubChem CID
592419
Structure
Preferred Compound
Molecular Formula
Status
Non-live
Molecular Weight
218.95 g/mol
Dates
- Create:2005-03-27
Chemical Structure Depiction
cycloheptane;cyclopentane;nickel
InChI=1S/C7H11.C5H5.Ni/c1-2-4-6-7-5-3-1;1-2-4-5-3-1;/h1-3H,4-7H2;1-5H;/q-3;-5;
KCGWZCKSSCITGF-UHFFFAOYSA-N
C1CC[CH-][CH-][CH-]C1.[CH-]1[CH-][CH-][CH-][CH-]1.[Ni]
C12H16Ni-8
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
218.95 g/mol
Property Name
Hydrogen Bond Donor Count
Property Value
0
Property Name
Hydrogen Bond Acceptor Count
Property Value
8
Property Name
Rotatable Bond Count
Property Value
0
Property Name
Exact Mass
Property Value
218.060542 g/mol
Property Name
Monoisotopic Mass
Property Value
218.060542 g/mol
Property Name
Topological Polar Surface Area
Property Value
0 A^2
Property Name
Heavy Atom Count
Property Value
13
Property Name
Formal Charge
Property Value
-8
Property Name
Complexity
Property Value
73.5
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
3
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
CONTENTS