Geometry & MOs

Info

ID:	76823
PubChem CID:	48425431
Reduced:	FSN2O2C16H19 (1)
Stoich.:	ABC2D2E16F19 (1)
Weight, g/mol:	292.142307
ΔH_f, kcal/mol:	-116.41
Dipole, Da:	3.42
IP(EA), eV:	-8.76(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-benzodioxol-5-yl)-N-[2-(diethylamino)-2-oxoethyl]acetamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=C(C2=C(S1)C=CC(=C2)F)C

DOS

IR

Vibrations