Geometry & MOs

Info

ID:	185218
PubChem CID:	77271299
Reduced:	S2O3N4C18H20 (1)
Stoich.:	A2B3C4D18E20 (1)
Weight, g/mol:	209.121592
ΔH_f, kcal/mol:	-49.54
Dipole, Da:	3.01
IP(EA), eV:	-8.53(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethyl-2-(3-fluorophenyl)morpholine

Drug info:

PubChemData

Smile

CC1=C(C=C(S1)C(=O)NC2CS(=O)(=O)CCC2N)C3=C4C=CC=CN4N=C3

DOS

IR

Vibrations