Geometry & MOs

Info

ID:	64286
PubChem CID:	29198897
Reduced:	SCl2N3O7H15C17 (1)
Stoich.:	AB2C3D7E15F17 (1)
Weight, g/mol:	417.152241
ΔH_f, kcal/mol:	-176.28
Dipole, Da:	5.36
IP(EA), eV:	-9.6(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluorophenyl)-N-[(2S)-2-(1H-indol-3-yl)-2-morpholin-4-ylethyl]methanesulfonamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)CNS(=O)(=O)C2=CC(=C(C=C2)Cl)Cl

DOS

IR

Vibrations