Geometry & MOs

Info

ID:	61571
PubChem CID:	26710636
Reduced:	S2N3O3H19C21 (1)
Stoich.:	A2B3C3D19E21 (1)
Weight, g/mol:	312.127406
ΔH_f, kcal/mol:	8.97
Dipole, Da:	5.66
IP(EA), eV:	-8.85(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluorophenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C2=CC=C(S2)CNC(=O)/C=C/C3=CC(=C(C=C3)OCC#N)OC

DOS

IR

Vibrations