Geometry & MOs

Info

ID:	135425
PubChem CID:	51870025
Reduced:	NO4C15H15 (1)
Stoich.:	AB4C15D15 (1)
Weight, g/mol:	351.108228
ΔH_f, kcal/mol:	-93.45
Dipole, Da:	2.85
IP(EA), eV:	-8.82(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-3-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CN(C[C@H]1COC2=CC=CC=C2O1)C(=O)C3=CC=CO3

DOS

IR

Vibrations