Chemical ID: 4873378

c1nc(nn1CCC#N)N=N=N
Chemical ID:
4873378
Name [?]:
None
SMILES [?]:
c1nc(nn1CCC#N)N=N=N
InChi [?]:
InChI=1/C5H6N7/c6-2-1-3-12-4-8-5(10-12)9-11-7/h4,7H,1,3H2
InChi Info:
AuxInfo=1/0/N:7,8,6,1,3,9,12,2,10,4,11,5/CRV:11.4/rA:12nCNCNNCCCNNN4N/rB:d1;s2;d3;s1s4;s5;s6;s7;t8;s3;d10;d11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C5H7N7
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:5.33752
Area:345.125
Solvation:-3.29062
Coulombic:-28.4305
Bond Count [?]
All:12
Single:7
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:165.156
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:0.35
LogP (Chemaxon):0.41

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Descriptor Annotations

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