Chemical ID: 7558005

c1ccc2c(c1)ccc3c2ccnc3
Chemical ID:
7558005
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)ccc3c2ccnc3
InChi [?]:
InChI=1/C13H9N/c1-2-4-12-10(3-1)5-6-11-9-14-8-7-13(11)12/h1-9H
InChi Info:
AuxInfo=1/0/N:1,2,6,3,7,8,11,12,14,5,9,4,10,13/rA:14nCCCCCCCCCCCCNC/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;d11;s12;s9d13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H9N
All Atoms:23
Heavy Atoms:14
Chiral Atoms:None
ZAP Information [?]
Total:6.86456
Area:334.541
Solvation:-1.49897
Coulombic:-6.72095
Bond Count [?]
All:16
Single:9
Double:7
Rotors:0
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.3
LogP (Chemaxon):None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue