Geometry & MOs

Info

ID:

318261

PubChem CID:

126650130

Reduced:

SN3F4O5H21C23 (1)

Stoich.:

AB3C4D5E21F23 (1)

Weight, g/mol:

549.080396

ΔHf, kcal/mol:

-314.73

Dipole, Da:

6.29

IP(EA), eV:

 -9.37(-0.96)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4S)-N-(6-fluoropyridin-2-yl)-4-[2-(2-methyl-1,3-thiazol-4-yl)-4-(trifluoromethyl)phenyl]-3,4-dihydro-2H-chromene-7-sulfonamide

Drug info:

PubChemData

Smile

COCCOC1=C(C=CC(=C1)C(F)(F)F)[C@H]2CCOC3=C2C=CC(=C3)S(=O)(=O)NC4=NC=C(C=N4)F

DOS

IR

Vibrations