Chemical ID: 6816118

C[NH+]1CCc2c(c3ccccc3[nH]2)C1
Chemical ID:
6816118
Name [?]:
None
SMILES [?]:
C[NH+]1CCc2c(c3ccccc3[nH]2)C1
InChi [?]:
InChI=1/C12H14N2/c1-14-7-6-12-10(8-14)9-4-2-3-5-11(9)13-12/h2-5,13H,6-8H2,1H3/p+1
InChi Info:
AuxInfo=1/1/N:1,9,10,8,11,4,3,14,7,6,12,5,13,2/rA:14cCN+CCCCCCCCCCNC/rB:s1;s2;s3;s4;d5;s6;s7;d8;s9;d10;d7s11;s5s12;s2s6;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H15N2+
All Atoms:29
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:-22.897
Area:345.606
Solvation:-31.5372
Coulombic:18.8199
Bond Count [?]
All:16
Single:12
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:187.261
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:1.7
LogP (Chemaxon):1.88

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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