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
-0.9717 -0.8467 -0.7768 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2809 0.4262 -0.5896 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2688 1.0282 0.3635 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0708 -0.2281 1.2349 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2646 -1.0943 -0.0021 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3672 -0.2478 -0.5367 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0127 1.0419 -0.3448 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4842 -1.5714 -1.3582 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0891 1.0140 -0.9998 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5892 1.8864 0.8815 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7667 -0.1377 1.9093 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0153 -0.5660 1.6389 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5046 -2.1007 0.2289 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2954 -0.5353 -0.9996 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5587 1.9313 -0.6493 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