Geometry & MOs

Info

ID:	157430
PubChem CID:	56424130
Reduced:	NF3O3C20H20 (1)
Stoich.:	AB3C3D20E20 (1)
Weight, g/mol:	393.155178
ΔH_f, kcal/mol:	-242.52
Dipole, Da:	2.65
IP(EA), eV:	-8.92(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-methyl-2-[3-(trifluoromethyl)phenyl]propyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1COC2=CC=CC=C2O1)C3=CC(=CC=C3)C(F)(F)F

DOS

IR

Vibrations