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
-0.3302 1.1567 0.8474 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6832 1.3212 0.0033 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7388 0.1263 -0.8374 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7788 -0.1276 -0.9933 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9807 -0.1741 0.5366 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0079 -1.2243 0.8706 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0391 -1.0363 0.0781 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5923 1.8849 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3442 2.1684 -0.0592 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2765 0.1478 -1.7432 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9850 -1.0818 -1.4629 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2592 0.7503 -1.4112 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9791 -0.2775 0.8506 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1063 -1.9963 1.6044 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9377 -1.6377 0.1143 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