Geometry & MOs

Info

ID:	297437
PubChem CID:	117617467
Reduced:	SO3N4C19H30 (1)
Stoich.:	AB3C4D19E30 (1)
Weight, g/mol:	393.215138
ΔH_f, kcal/mol:	-64.28
Dipole, Da:	4.52
IP(EA), eV:	-8.72(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 6-[2-(2,2-dimethylpropanoyloxy)ethylcarbamoyloxy]hexanoate

Drug info:

PubChemData

Smile

CNCCN(C)CC1=CCN=C1C2=CC=C(C=C2)NS(=O)(=O)CCCOC

DOS

IR

Vibrations