Year |
Citation |
Score |
2014 |
Aldamen MA, Sinnokrot M. Crystallographic and theoretical studies of 1-(1-naphthyl)-2-thiourea with intermolecular N-H.S heteroatom interaction and N-H.π interaction Journal of Structural Chemistry. 55: 53-60. DOI: 10.1134/S0022476614010089 |
0.314 |
|
2009 |
Sherrill CD, Sumpter BG, Sinnokrot MO, Marshall MS, Hohenstein EG, Walker RC, Gould IR. Assessment of standard force field models against high-quality ab initio potential curves for prototypes of pi-pi, CH/pi, and SH/pi interactions. Journal of Computational Chemistry. 30: 2187-93. PMID 19242959 DOI: 10.1002/Jcc.21226 |
0.654 |
|
2006 |
Ringer AL, Figgs MS, Sinnokrot MO, Sherrill CD. Aliphatic C-H/pi interactions: Methane-benzene, methane-phenol, and methane-indole complexes. The Journal of Physical Chemistry. A. 110: 10822-8. PMID 16970377 DOI: 10.1021/Jp062740L |
0.68 |
|
2006 |
Sinnokrot MO, Sherrill CD. High-accuracy quantum mechanical studies of pi-pi interactions in benzene dimers. The Journal of Physical Chemistry. A. 110: 10656-68. PMID 16970354 DOI: 10.1021/Jp0610416 |
0.651 |
|
2006 |
Ringer AL, Sinnokrot MO, Lively RP, Sherrill CD. The effect of multiple substituents on sandwich and T-shaped pi-pi interactions. Chemistry (Weinheim An Der Bergstrasse, Germany). 12: 3821-8. PMID 16514687 DOI: 10.1002/Chem.200501316 |
0.674 |
|
2004 |
Sinnokrot MO, Sherrill CD. Substituent effects in pi-pi interactions: sandwich and T-shaped configurations. Journal of the American Chemical Society. 126: 7690-7. PMID 15198617 DOI: 10.1021/Ja049434A |
0.725 |
|
2004 |
Sinnokrot MO, Sherrill CD. Highly accurate coupled cluster potential energy curves for the benzene dimer: Sandwich, T-shaped, and parallel-displaced configurations Journal of Physical Chemistry A. 108: 10200-10207. DOI: 10.1021/Jp0469517 |
0.69 |
|
2003 |
Sinnokrot MO, Sherrill CD. Unexpected substituent effects in face-to-face π-stacking interactions Journal of Physical Chemistry A. 107: 8377-8379. DOI: 10.1021/Jp030880E |
0.675 |
|
2002 |
Sinnokrot MO, Valeev EF, Sherrill CD. Estimates of the ab initio limit for pi-pi interactions: the benzene dimer. Journal of the American Chemical Society. 124: 10887-93. PMID 12207544 DOI: 10.1021/Ja025896H |
0.677 |
|
2001 |
Sinnokrot MO, Sherrill CD. Density functional theory predictions of anharmonicity and spectroscopic constants for diatomic molecules Journal of Chemical Physics. 115: 2439-2448. DOI: 10.1063/1.1386412 |
0.608 |
|
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