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
-1.1572 -0.1681 0.9006 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1431 -0.9815 -0.1528 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0206 -0.5685 -0.9636 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1231 0.9651 -0.8048 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0604 0.8523 0.7333 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2240 0.1375 0.8584 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2868 -0.7237 -0.1517 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8627 -0.2543 1.7331 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8237 -1.7816 -0.3909 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0786 -0.8992 -1.9632 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0896 1.3053 -1.1523 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7561 1.4529 -1.2143 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1888 1.7600 1.2518 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9592 0.2951 1.6268 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1235 -1.3913 -0.3103 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