(3S,4R)-3-Hydroxy-2,2-Dimethyl-4-[(1-Methyl-6-Oxo-1,6-Dihydro-3-Pyridazinyl)Oxy]-6-Chromanecarbonitrile

Molecule SVG Image

Properties Simple | Detailed

Formula C17H17N3O4+
IUPAC Name (3s,4r)-3-hydroxy-2,2-dimethyl-4-(1-methyl-6-oxo-pyridazin-3-yl)oxy-chromane-6-carbonitrile
Molecular Mass 327.335 g·mol−1
Heat of Formation -313.6 ± 16.7 kJ·mol−1
Dipole Moment 6.94 ± 1.08 D
Volume 380.29 Å 3
Surface Area 332.02 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -1.07 ± eV
Point Group Symmetry C1
InChIKey RIBYSHCVSQIIJE-CVEARBPZSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N