Geometry & MOs

Info

ID:	160461
PubChem CID:	57309809
Reduced:	SN4O7C16H18 (1)
Stoich.:	AB4C7D16E18 (1)
Weight, g/mol:	259.141973
ΔH_f, kcal/mol:	-238.61
Dipole, Da:	3.3
IP(EA), eV:	-10.15(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methylpropan-2-yl)oxy]-2-(2-oxoethoxy)piperidine-1-carboxylic acid

Drug info:

PubChemData

Smile

COC1=CC(=NC(=N1)CNC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC

DOS

IR

Vibrations