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
    0.5454    2.5843    0.4742 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3572    1.4452    0.2695 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1451    0.0547    0.0082 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0908   -0.3895   -0.0574 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2102   -0.8869   -0.1872 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0599   -1.6607   -0.3387 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3218   -1.4484   -0.2553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9052    0.3014    0.0865 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