Geometry & MOs

Info

ID:	348455
PubChem CID:	127273556
Reduced:	SN3O5C18H25 (1)
Stoich.:	AB3C5D18E25 (1)
Weight, g/mol:	398.211804
ΔH_f, kcal/mol:	-180.7
Dipole, Da:	8.34
IP(EA), eV:	-9.4(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-fluoro-5-morpholin-4-ylphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCN(CC1)C(=O)[C@H]2COCC(=O)N2CC3=CC=CC=C3

DOS

IR

Vibrations