Geometry & MOs

Info

ID:	355137
PubChem CID:	127288069
Reduced:	O3N4C20H28 (1)
Stoich.:	A3B4C20D28 (1)
Weight, g/mol:	396.171893
ΔH_f, kcal/mol:	-115.92
Dipole, Da:	3.28
IP(EA), eV:	-8.8(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide

Drug info:

PubChemData

Smile

CCN1CCC(CC1)N(C)C(=O)CCC(=O)N2CC(=O)NC3=CC=CC=C32

DOS

IR

Vibrations