Chemical ID: 4945084

c1ccc(cc1)C(c2ccccc2)(C(=[OH+])O)[OH2+]
Chemical ID:
4945084
Name [?]:
(1-hydroxy-2-oxonio-2,2-diphenyl-ethylidene)oxonium
SMILES [?]:
c1ccc(cc1)C(c2ccccc2)(C(=[OH+])O)[OH2+]
InChi [?]:
InChI=1/C14H12O3/c15-13(16)14(17,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,17H,(H,15,16)/p+2
InChi Info:
AuxInfo=1/1/N:1,11,2,6,10,12,3,5,9,13,4,8,14,7,15,16,17/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12)(15,16)/rA:17nCCCCCCCCCCCCCCO+OO+/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s10;d11;d8s12;s7;w14;s14;s7;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H14O3+2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:-116.657
Area:389.282
Solvation:-126.389
Coulombic:20.1182
Bond Count [?]
All:18
Single:11
Double:7
Rotors:3
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:230.259
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.36
LogP (Chemaxon):2.9

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