Chemical ID: 6176411

Cc1cn2c([nH+]1)-c3ccccc3C2
Chemical ID:
6176411
Name [?]:
None
SMILES [?]:
Cc1cn2c([nH+]1)-c3ccccc3C2
InChi [?]:
InChI=1/C11H10N2/c1-8-6-13-7-9-4-2-3-5-10(9)11(13)12-8/h2-6H,7H2,1H3/p+1
InChi Info:
AuxInfo=1/1/N:1,10,9,11,8,3,13,2,12,7,5,6,4/rA:13nCCCNCN+CCCCCCC/rB:s1;d2;s3;s4;s2d5;s5;s7;d8;s9;d10;d7s11;s4s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H11N2+
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:-22.2895
Area:329.445
Solvation:-30.5256
Coulombic:-3.70287
Bond Count [?]
All:15
Single:10
Double:5
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:171.219
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.61
LogP (Chemaxon):2.19

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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