4-{3-[(Phenylsulfonyl)Amino]-1-Propyn-1-Yl}-N-(3,3,3-Trifluoropropyl)Benzamide

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Properties Simple | Detailed

Formula C19H17F3N2O3S
IUPAC Name 4-[3-(benzenesulfonamido)prop-1-ynyl]-n-(3,3,3-trifluoropropyl)benzamide
Molecular Mass 410.410 g·mol−1
Heat of Formation -764.0 ± 16.7 kJ·mol−1
Dipole Moment 6.21 ± 1.08 D
Volume 449.78 Å 3
Surface Area 414.93 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -1.30 ± eV
Point Group Symmetry C1
InChIKey DQYDOIDOCLZFRS-UHFFFAOYSA-N
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