Geometry & MOs

Info

ID:	153625
PubChem CID:	56312894
Reduced:	FN2O5C21H25 (1)
Stoich.:	AB2C5D21E25 (1)
Weight, g/mol:	421.06888
ΔH_f, kcal/mol:	-207.1
Dipole, Da:	3.09
IP(EA), eV:	-9.25(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-N-[2-(2-fluorophenyl)-2-methylpropyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC(=C(C(=C1)OC)OCC(=O)N)OC)C2=CC=CC=C2F

DOS

IR

Vibrations