Chemical ID: 5125282

c1ccc(cc1)C2=C(C2(C#N)c3ccccc3)c4ccccc4
Chemical ID:
5125282
Name [?]:
1,2,3-triphenylcycloprop-2-ene-1-carbonitrile
SMILES [?]:
c1ccc(cc1)C2=C(C2(C#N)c3ccccc3)c4ccccc4
InChi [?]:
InChI=1/C22H15N/c23-16-22(19-14-8-3-9-15-19)20(17-10-4-1-5-11-17)21(22)18-12-6-2-7-13-18/h1-15H
InChi Info:
AuxInfo=1/0/N:1,21,15,2,6,20,22,14,16,3,5,19,23,13,17,10,4,18,12,7,8,9,11/E:(1,2)(4,5,6,7)(8,9)(10,11,12,13)(14,15)(17,18)(20,21)/rA:23nCCCCCCCCCCNCCCCCCCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;d7;s7s8;s9;t10;s9;s12;d13;s14;d15;d12s16;s8;s18;d19;s20;d21;d18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H15N
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:11.5904
Area:525.725
Solvation:-1.55274
Coulombic:-9.57438
Bond Count [?]
All:26
Single:15
Double:10
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:293.361
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:5.42
LogP (Chemaxon):5.22

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