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
0.7712 0.1464 -1.2509 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1733 1.0481 -1.0365 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9213 0.6234 0.1538 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8954 -0.9040 -0.0633 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6431 -0.9007 -0.1688 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9787 -0.2298 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0403 0.6911 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5260 0.0871 -2.0179 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3610 1.9266 -1.6204 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8829 1.0279 0.3233 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3673 -1.1925 -0.9963 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2443 -1.3859 0.8416 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0744 -1.8384 -0.3909 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8356 -0.4604 1.7024 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0236 1.3611 2.1368 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