Geometry & MOs

Info

ID:	276578
PubChem CID:	103824360
Reduced:	OF2N2C13H18 (1)
Stoich.:	AB2C2D13E18 (1)
Weight, g/mol:	342.05791
ΔH_f, kcal/mol:	-128.74
Dipole, Da:	3.58
IP(EA), eV:	-9.04(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-N,2,2-trimethylpropanamide

Drug info:

PubChemData

Smile

CC(C)(CNCC1=C(C=CC=C1F)F)C(=O)NC

DOS

IR

Vibrations