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
-0.4069 -1.1630 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3192 -0.2039 0.6696 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7502 0.7850 -0.2883 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0541 -0.1987 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7444 -0.8361 -0.0931 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3713 0.3764 0.4399 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4638 1.3473 0.3721 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5016 -2.0303 1.4168 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2699 -0.1739 1.1783 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4137 1.4627 -0.7439 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7599 -0.8949 -1.6906 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5941 0.3441 -1.9381 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3668 -1.6403 -0.3893 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3757 0.4659 0.8154 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5593 2.3595 0.7204 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