Monomers
2,5-Norbornadiene
Identifiers
IUPAC name
bicyclo[2.2.1]hepta-2,5-diene
InchI
InChI=1S/C7H8/c1-2-7-4-3-6(1)5-7/h1-4,6-7H,5H2
InchI Key
SJYNFBVQFBRSIB-UHFFFAOYSA-N
SMILES
C1=CC2CC1C=C2
Canonical SMILES
C1C2C=CC1C=C2
Isomeric SMILES
C1C2C=CC1C=C2
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C7H8
Heavy Atom Count
7
Molecular Weight
92.141
Exact Molecular Weight
92.0626
Valence Electrons
36
Radical Electrons
0
tPSA
0.0
MolLogP
1.7485
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
2
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
2
Aromatic Rings
0
MOL File
RDKit 3D
15 16 0 0 0 0 0 0 0 0999 V2000
0.6552 1.2620 -0.4123 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3119 0.1512 -0.7111 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5892 -0.9518 -0.0634 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1399 -0.2294 1.2247 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5394 0.8916 0.3967 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4707 0.0308 -0.3738 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7622 -1.0292 -0.7356 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9077 2.2691 -0.6865 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2032 0.0370 -1.3076 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0786 -1.8708 0.0889 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9823 0.1816 1.7751 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5840 -0.8071 1.7864 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9677 1.6572 0.9895 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4986 0.2457 -0.5803 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0455 -1.8378 -1.3907 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 1 0
4 5 1 0
5 6 1 0
6 7 2 0
5 1 1 0
7 3 1 0
1 8 1 0
2 9 1 0
3 10 1 0
4 11 1 0
4 12 1 0
5 13 1 0
6 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers