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
-0.9842 0.5354 0.9541 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3389 0.5996 -0.3449 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2689 -0.1112 -1.0762 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0099 -1.2679 -0.0916 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2694 -0.2843 1.0608 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3432 0.5147 0.4367 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9955 0.6444 -0.8643 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5356 1.0091 1.7636 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2003 1.0567 -0.7919 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4773 -0.4213 -2.0691 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9152 -1.8348 0.1049 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8698 -1.8436 -0.3558 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4571 -0.7338 1.9957 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2484 0.9402 0.8705 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5470 1.1968 -1.5925 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