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
-0.0510 1.4121 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1273 0.7800 -0.6138 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9927 -0.5458 0.0158 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1601 -0.1572 1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9160 0.5220 0.3846 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2547 -0.6465 -0.4845 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0829 -1.2721 -0.7403 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3100 2.3759 -0.8015 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9408 1.2377 -1.1306 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8684 -1.0961 0.2232 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6731 0.5360 1.8989 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2542 -1.0545 1.7052 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7091 0.9628 0.9203 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2410 -0.9210 -0.8292 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0564 -2.1333 -1.3701 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