| SpectraBase Spectrum ID |
LvIXdxn44SM |
| Name |
N,N'-bis(4-Chlorobenzylidene)benzidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
428.084703988 u |
| Formula |
C26H18Cl2N2 |
| InChI |
InChI=1S/C26H18Cl2N2/c27-23-9-1-19(2-10-23)17-29-25-13-5-21(6-14-25)22-7-15-26(16-8-22)30-18-20-3-11-24(28)12-4-20/h1-18H/b29-17+,30-18+ |
| InChIKey |
ISALVHOEWQZBNC-YAGSLNJISA-N |
| Molecular Weight |
429.350 g/mol |
| SMILES |
c1(ccc(cc1)\C=N\c1ccc(cc1)-c1ccc(cc1)\N=C\c1ccc(cc1)Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.823294 |