Geometry & MOs

Info

ID:	274281
PubChem CID:	103808261
Reduced:	FN2O2C15H21 (1)
Stoich.:	AB2C2D15E21 (1)
Weight, g/mol:	310.090662
ΔH_f, kcal/mol:	-111.04
Dipole, Da:	4.58
IP(EA), eV:	-8.98(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CN(CCOC1=CC=CC=C1F)C(=O)[C@@H]2CCCCN2

DOS

IR

Vibrations