Geometry & MOs

Info

ID:	343201
PubChem CID:	127266374
Reduced:	FON2C8H8 (2)
Stoich.:	ABC2D8E8 (2)
Weight, g/mol:	295.116821
ΔH_f, kcal/mol:	-79.87
Dipole, Da:	6.35
IP(EA), eV:	-9.26(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-(2-methyl-3-nitrophenyl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CN1C(=CC(=N1)C2=CC(=CC(=C2)F)F)NC(=O)NC(CC#C)CO

DOS

IR

Vibrations