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
-1.2773 0.7425 0.2266 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5321 1.0833 -0.8194 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5574 0.1007 -0.9622 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1973 -1.1596 -0.4876 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6100 -0.4725 0.8321 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7022 -0.0244 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4405 0.2855 0.2339 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1734 1.2565 0.5471 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6679 1.9253 -1.4752 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0366 0.0062 -1.8959 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0618 -1.3612 -1.1174 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4819 -1.9933 -0.3133 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2169 -1.0558 1.4641 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0570 0.0580 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4611 0.6089 0.1562 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