Geometry & MOs

Info

ID:	357558
PubChem CID:	127294221
Reduced:	FO2N3C20H20 (1)
Stoich.:	AB2C3D20E20 (1)
Weight, g/mol:	394.172642
ΔH_f, kcal/mol:	-65.51
Dipole, Da:	5.53
IP(EA), eV:	-9.01(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-fluorophenyl)oxan-4-yl]-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylacetamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1)C(=O)NC3(CCOCC3)C4=CC=C(C=C4)F)NN=C2

DOS

IR

Vibrations