Geometry & MOs

Info

ID:	354690
PubChem CID:	127287389
Reduced:	ClFN3O3C19H27 (1)
Stoich.:	ABC3D3E19F27 (1)
Weight, g/mol:	383.202048
ΔH_f, kcal/mol:	-169.64
Dipole, Da:	6.56
IP(EA), eV:	-9.05(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-difluorophenyl)-N-(3-morpholin-4-ylbutan-2-yl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(C)N1CCOCC1)NC(=O)N2CCOC(C2)C3=CC(=C(C=C3)F)Cl

DOS

IR

Vibrations