Chemical ID: 5260876

C(c1n[nH]c(=N)o1)c2n[nH]c(=N)o2
Chemical ID:
5260876
Name [?]:
5-[(5-imino-4H-1,3,4-oxadiazol-2-yl)methyl]-3H-1,3,4-oxadiazol-2-imine
SMILES [?]:
C(c1n[nH]c(=N)o1)c2n[nH]c(=N)o2
InChi [?]:
InChI=1/C5H6N6O2/c6-4-10-8-2(12-4)1-3-9-11-5(7)13-3/h1H2,(H2,6,10)(H2,7,11)
InChi Info:
AuxInfo=1/1/N:1,2,8,5,11,6,12,3,9,4,10,7,13/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)/gE:(1,2)/rA:13nCCNNCNOCNNCNO/rB:s1;d2;s3;s4;w5;s2s5;s1;d8;s9;s10;w11;s8s11;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C5H6N6O2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:5.80856
Area:343.363
Solvation:-2.77551
Coulombic:-61.7325
Bond Count [?]
All:14
Single:10
Double:4
Rotors:2
Chiral:2
Rigid Segments:2
Chemical Properties
Molecular Weight:182.14
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:1.69
LogP (Chemaxon):0.48

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