Chemical ID: 5073391

Cc1c2ccccc2cc3c1c4cccc[n+]4cc3
Chemical ID:
5073391
Name [?]:
None
SMILES [?]:
Cc1c2ccccc2cc3c1c4cccc[n+]4cc3
InChi [?]:
InChI=1/C18H14N/c1-13-16-7-3-2-6-14(16)12-15-9-11-19-10-5-4-8-17(19)18(13)15/h2-12H,1H3/q+1
InChi Info:
AuxInfo=1/0/N:1,6,5,14,15,7,4,13,19,16,18,9,2,8,10,3,12,11,17/CRV:19+1/rA:19nCCCCCCCCCCCCCCCCN+CC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d9;d2s10;s11;s12;d13;s14;d15;d12s16;s17;s10d18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H14N+
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:-16.4298
Area:404.279
Solvation:-26.5367
Coulombic:16.4182
Bond Count [?]
All:22
Single:13
Double:9
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:244.311
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:4.92
LogP (Chemaxon):2.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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