Geometry & MOs

Info

ID:	194530
PubChem CID:	78549944
Reduced:	NSO7C20H23 (1)
Stoich.:	ABC7D20E23 (1)
Weight, g/mol:	411.146407
ΔH_f, kcal/mol:	-239.65
Dipole, Da:	1.6
IP(EA), eV:	-9.6(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(ethylcarbamoylamino)-2-oxoethyl] 3-(2-methylpiperidin-1-yl)sulfonylbenzoate

Drug info:

PubChemData

Smile

CC1CCCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=C(O3)C(=O)OC

DOS

IR

Vibrations