Geometry & MOs

Info

ID:	349616
PubChem CID:	127275768
Reduced:	ClFN2O3C17H22 (1)
Stoich.:	ABC2D3E17F22 (1)
Weight, g/mol:	340.159849
ΔH_f, kcal/mol:	-171.87
Dipole, Da:	4.3
IP(EA), eV:	-9.54(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-difluorophenyl)-N-(oxan-2-ylmethyl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCOC(C1)CNC(=O)N2CCOC(C2)C3=CC(=C(C=C3)F)Cl

DOS

IR

Vibrations