Chemical ID: 6693071

c1cn2cnc3c(c2n1)[nH]cn3
Chemical ID:
6693071
Name [?]:
None
SMILES [?]:
c1cn2cnc3c(c2n1)[nH]cn3
InChi [?]:
InChI=1/C7H5N5/c1-2-12-4-11-6-5(7(12)8-1)9-3-10-6/h1-4H,(H,9,10)
InChi Info:
AuxInfo=1/1/N:1,2,11,4,7,6,8,9,10,12,5,3/rA:12nCCNCNCCCNNCN/rB:d1;s2;s3;d4;s5;d6;s3s7;s1d8;s7;s10;s6d11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H5N5
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:5.26902
Area:296.322
Solvation:-2.13904
Coulombic:-32.5483
Bond Count [?]
All:14
Single:9
Double:5
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:159.148
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:-0.08
LogP (Chemaxon):0.01

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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