Monomers

Vinylidene cyanide

Identifiers

IUPAC name
2-methylidenepropanedinitrile
InchI
InChI=1S/C4H2N2/c1-4(2-5)3-6/h1H2
InchI Key
FCYVWWWTHPPJII-UHFFFAOYSA-N
SMILES
N#CC(=C)C#N
Canonical SMILES
C=C(C#N)C#N
Isomeric SMILES
C=C(C#N)C#N
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H2N2
Heavy Atom Count
6
Molecular Weight
78.074
Exact Molecular Weight
78.0218
Valence Electrons
28
Radical Electrons
0
tPSA
47.58
MolLogP
0.5898
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

  8  7  0  0  0  0  0  0  0  0999 V2000
    0.1268    2.6071   -0.5445 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1186    1.4694   -0.3302 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0949    0.0544   -0.0839 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8271   -0.4589    0.7328 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0577   -0.8061   -0.7125 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8404   -1.5058   -1.2013 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8632   -1.5200    0.9321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5480    0.1599    1.2075 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  3  0
  2  3  1  0
  3  4  2  3
  3  5  1  0
  5  6  3  0
  4  7  1  0
  4  8  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers