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
-0.6186 1.1658 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2302 -0.0019 -0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5098 -0.9928 0.0133 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2569 -0.0942 1.2415 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4339 0.9752 0.3703 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4697 0.0842 -0.2489 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8636 -1.0722 -0.5085 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8802 2.0723 -1.1924 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0693 -0.2397 -1.4664 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0210 -1.8921 0.2248 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4410 -0.5551 1.9429 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1870 0.2666 1.6697 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7825 1.8222 0.8904 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4781 0.3810 -0.4202 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3040 -1.9194 -1.0136 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