Geometry & MOs

Info

ID:	447586
PubChem CID:	135284010
Reduced:	S2F4N4O4H22C23 (1)
Stoich.:	A2B4C4D4E22F23 (1)
Weight, g/mol:	440.134068
ΔH_f, kcal/mol:	-273.37
Dipole, Da:	8.18
IP(EA), eV:	-9.1(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-phenylpiperidin-1-yl)-N-(1,2,4-thiadiazol-5-yl)-2,3-dihydro-1H-indene-2-sulfonamide

Drug info:

PubChemData

Smile

C1COC2=C([C@H]1N3CC[C@@](C[C@@H]3C4=CC=C(C=C4)F)(C(F)(F)F)O)C=CC(=C2)S(=O)(=O)NC5=NC=NS5

DOS

IR

Vibrations