Geometry & MOs

Info

ID:	352039
PubChem CID:	127283107
Reduced:	FN3O3C20H30 (1)
Stoich.:	AB3C3D20E30 (1)
Weight, g/mol:	257.156184
ΔH_f, kcal/mol:	-182.77
Dipole, Da:	2.95
IP(EA), eV:	-8.86(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(1-methylpiperidin-4-yl)thiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC(=O)NCC(C2=CC=C(C=C2)F)N3CCOCC3)O

DOS

IR

Vibrations