Geometry & MOs

Info

ID:	65944
PubChem CID:	46484660
Reduced:	N3O3F5H14C19 (1)
Stoich.:	A3B3C5D14E19 (1)
Weight, g/mol:	370.107733
ΔH_f, kcal/mol:	-331.21
Dipole, Da:	3.45
IP(EA), eV:	-9.64(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluoro-4-nitrophenoxy)-N-[(1-phenylpyrazol-4-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(=O)N1)CC(=O)NC2=CC(=CC(=C2)F)F)C3=CC(=CC=C3)C(F)(F)F

DOS

IR

Vibrations