Chemical ID: 5259133

c1ccnc(c1)[NH2+]c2ccccn2
Chemical ID:
5259133
Name [?]:
bis(2-pyridyl)ammonium
SMILES [?]:
c1ccnc(c1)[NH2+]c2ccccn2
InChi [?]:
InChI=1/C10H9N3/c1-3-7-11-9(5-1)13-10-6-2-4-8-12-10/h1-8H,(H,11,12,13)/p+1
InChi Info:
AuxInfo=1/1/N:1,10,2,11,6,9,3,12,5,8,4,13,7/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)/rA:13nCCCNCCN+CCCCCN/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s10;d11;d8s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H10N3+
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:-24.7871
Area:337.489
Solvation:-33.2243
Coulombic:29.2236
Bond Count [?]
All:14
Single:8
Double:6
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:172.207
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:2.19
LogP (Chemaxon):2.07

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Descriptor Annotations

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