Cis-4-({2-Amino-5-[(4-Chlorophenyl)Ethynyl]-4-Pyrimidinyl}Amino)Cyclohexanol
Properties
Property | Value |
---|---|
Formula | C18H19ClN4O |
IUPAC Name | 4-[[2-amino-5-[2-(4-chlorophenyl)ethynyl]pyrimidin-4-yl]amino]cyclohexanol |
Molecular Mass | 342.823 g·mol−1 |
Heat of Formation | 145.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.31 ± 1.08 D |
Volume | 407.09 Å 3 |
Surface Area | 355.55 Å 2 |
HOMO Energy | -8.49 ± 0.55 eV |
LUMO Energy | 2.30 ± eV |
Point Group Symmetry | C1 |
InChIKey | XBVOXAWRUIZEMG-IYBDPMFKSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O Cl |