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
0.5429 1.3475 -0.1543 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3394 0.3603 -0.5622 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6531 -0.8941 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1073 -0.4726 1.1717 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6249 0.7442 0.5628 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4411 0.0516 -0.4408 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6390 -0.9053 -0.9574 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7316 2.4032 -0.3257 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2940 0.4730 -1.0523 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2108 -1.7909 -0.2067 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8966 -0.1727 1.8465 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6210 -1.1893 1.5412 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1075 1.3616 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4718 0.2580 -0.7161 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8704 -1.5745 -1.7705 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