Geometry & MOs

Info

ID:	194464
PubChem CID:	78540864
Reduced:	F3N3O5H12C16 (1)
Stoich.:	A3B3C5D12E16 (1)
Weight, g/mol:	371.148121
ΔH_f, kcal/mol:	-223.75
Dipole, Da:	7.24
IP(EA), eV:	-9.43(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-morpholin-4-ylphenyl)-2-(3-nitrophenoxy)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=C(C(=C(C=C1)F)F)F)OC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

DOS

IR

Vibrations