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
1.1955 -0.1570 -0.8302 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4265 0.1224 0.4637 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0648 0.1264 1.1034 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5228 -1.0999 0.3733 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2647 -0.4645 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9788 0.8242 -0.7874 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6945 1.1959 0.4584 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9474 -0.1522 -1.5833 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3632 0.3097 0.9757 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0554 0.0516 2.1605 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5795 -1.2258 0.5793 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1078 -1.9808 0.5032 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5338 -1.0465 -1.8343 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6077 1.3654 -1.4897 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9789 2.1310 0.9124 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