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1,3-bis(1H-imidazol-1-yl)benzene

Catalog Number
ACM69506918-1
CAS Number
69506-91-8
Product Name
1,3-bis(1H-imidazol-1-yl)benzene
Category
Nitrogen-containing MOF ligand-binary nitrogen-containing MOF ligand
IUPAC Name
1-(3-imidazol-1-ylphenyl)imidazole
Molecular Weight
210.23g/mol
Molecular Formula
C12H10N4
InChI
InChI=1S/C12H10N4/c1-2-11(15-6-4-13-9-15)8-12(3-1)16-7-5-14-10-16/h1-10H
InChI Key
GDWGYEKGZJOUHE-UHFFFAOYSA-N
Complexity
211
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
210.090546336g/mol
Formal Charge
0
Heavy Atom Count
16
Hydrogen Bond Acceptor Count
2
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
210.090546336g/mol
Rotatable Bond Count
2
Topological Polar Surface Area
35.6Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
1.4
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