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Table 1 Photophysical data of compounds M1–6 in different solvents

From: Experimental and theoretical study of donor-π-acceptor compounds based on malononitrile

M

Chloroform

Methanol

Acetonitrile

ε, M−1

cm−1

× 104

λabs

λem

Stokes shift, cm−1

ε, M−1

cm−1

× 104

λabs

λem

Stokes shift, cm−1

ε, M−1

cm−1

× 104

λabs

λem

Stokes shift, cm−1

M1

2.35

305

377

6262

3.16

306

370

5653

2.35

304 (324)a

341

3569

M2

2.92

327

392

5071

2.20

323

370

3933

2.76

321 (348)

399

6090

M3

3.05

327

390

4940

3.23

321

372

4271

3.06

321 (434)

357

3141

M4

6.02

432

470

1872

5.77

429

481

2520

5.53

430 (403)

485

2637

M5

1.86

329

475

9343

1.86

322

511

11,486

1.92

320 (319)

496

11,089

M6

2.24

369

445

4628

2.16

353

459

6542

2.03

356 (437)

469

6768

  1. aData in brackets are theoretical values using PBEPBE/6–311++G** level of theory in acetonitrile solvent