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
-0.1065 1.4187 0.3561 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9401 0.6154 1.0109 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7349 -0.7412 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6224 -0.3331 -1.0558 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5409 0.6286 -0.7454 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4632 -0.3206 -0.0942 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6843 -1.1411 0.6447 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0582 2.4612 0.5972 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6009 0.9561 1.7947 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4758 -1.4681 0.6297 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5060 0.1869 -1.4034 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2734 -1.1716 -1.6596 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8915 1.1822 -1.5708 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5302 -0.3503 -0.1899 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0917 -1.9232 1.2568 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