Geometry & MOs

Info

ID:	310112
PubChem CID:	126574561
Reduced:	SF3O3N4H17C18 (1)
Stoich.:	AB3C3D4E17F18 (1)
Weight, g/mol:	446.142405
ΔH_f, kcal/mol:	-214.39
Dipole, Da:	10.85
IP(EA), eV:	-9.4(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[4-(6-fluoro-1H-indol-3-yl)phenyl]sulfonylamino]ethyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)C1=C(N=C(C=C1)NC(=O)C)C2=NC3=C(N2C)C=CC(=C3)C(F)(F)F

DOS

IR

Vibrations