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Chemical ID: 7529408
Chemical ID:
7529408
Name [?]:
9-ethylcarbazole-3-carbonitrile
SMILES [?]:
CCn1c2ccccc2c3c1ccc(c3)C#N
InChi [?]:
InChI=1/C15H12N2/c1-2-17-14-6-4-3-5-12(14)13-9-11(10-16)7-8-15(13)17/h3-9H,2H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,7,6,8,5,13,12,15,16,14,9,10,4,11,17,3/rA:17nCCNCCCCCCCCCCCCCN/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s3s10;d11;s12;d13;d10s14;s14;t16;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H12N2 |
All Atoms: | 29 |
Heavy Atoms: | 17 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 8.70668 |
Area: | 408.645 |
Solvation: | -1.50944 |
Coulombic: | -11.1213 |
Bond Count [?]
All: | 19 |
Single: | 12 |
Double: | 6 |
Rotors: | 1 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.98 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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