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
1.1130 -0.9545 0.0738 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4463 0.3424 0.1752 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1988 1.1104 -0.0473 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4034 0.2563 -1.1778 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3004 -1.0297 -0.3352 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1119 -0.5787 0.8438 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7506 0.7044 1.0421 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8134 -1.7573 0.2733 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4583 0.7000 0.3831 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2729 2.1407 -0.2493 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2253 0.2259 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4500 0.5301 -1.3286 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6354 -1.9053 -0.8221 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8171 -1.1444 1.4016 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0589 1.3597 1.8234 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