Geometry & MOs
Info
ID: |
147575 |
PubChem CID: |
53787231 |
Reduced: |
NO4C8H15 (1) |
Stoich.: |
AB4C8D15 (1) |
Weight, g/mol: |
2554.739646 |
ΔHf, kcal/mol: |
-173.34 |
Dipole, Da: |
2.89 |
IP(EA), eV: |
-10.04(-0.25) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(3S,4R)-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-[(4-ethylphenyl)sulfonylamino]-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carboxamide;4-ethyl-N-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-3,4-dihydrochromen-4-yl]benzenesulfonamide;4-[(4-ethylphenyl)sulfonylamino]-3-hydroxy-2,2-dimethyl-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-3,4-dihydrochromene-6-carboxamide;(3S,4R)-4-[(4-ethylphenyl)sulfonylamino]-3-hydroxy-2,2-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-3,4-dihydrochromene-6-carboxamide;(3S,4R)-4-[(4-ethylphenyl)sulfonylamino]-3-hydroxy-2,2-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)-3,4-dihydrochromene-6-carboxamide