Geometry & MOs

Info

ID:	447614
PubChem CID:	135284238
Reduced:	S2F3O3N4C17H19 (1)
Stoich.:	A2B3C3D4E17F19 (1)
Weight, g/mol:	473.124312
ΔH_f, kcal/mol:	-214.68
Dipole, Da:	6.5
IP(EA), eV:	-9.35(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-6-fluoro-4-[(2S)-2-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)-3,4-dihydro-2H-chromene-7-sulfonamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(F)(F)F)C2CCOC3=C2C=CC(=C3)S(=O)(=O)NC4=NC=NS4

DOS

IR

Vibrations