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
0.7440 -1.1026 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2866 0.1143 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4207 1.0502 0.0102 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2084 0.1819 -1.2444 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3292 -0.9885 -0.3981 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4656 -0.2715 0.2638 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9473 0.9343 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0561 -1.9953 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1815 0.3118 1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7826 2.0218 -0.1734 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1354 -0.0596 -1.7435 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5865 0.6117 -1.8517 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5818 -1.8528 -0.9515 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4627 -0.6378 0.4315 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4421 1.6819 1.1890 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