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
1.1355 -0.9180 0.3132 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4065 0.1693 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0969 0.7219 -0.8196 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7856 -0.5464 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3421 -0.9319 0.5776 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6517 0.3571 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4773 1.3535 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8764 -1.6417 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3517 0.6170 -0.6698 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0694 1.2896 -1.7088 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4397 -1.2616 -1.5903 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8381 -0.2741 -0.8863 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7566 -1.8117 0.9639 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9650 0.4674 2.2945 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6803 2.4098 0.4816 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