Geometry & MOs

Info

ID:	249421
PubChem CID:	103089344
Reduced:	NSO2C11H23 (1)
Stoich.:	ABC2D11E23 (1)
Weight, g/mol:	247.1606
ΔH_f, kcal/mol:	-114.27
Dipole, Da:	3.51
IP(EA), eV:	-8.58(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(2-methylpropylamino)-5-methylsulfanylpentanoate

Drug info:

PubChemData

Smile

CC(C)CNC(CCCSC)C(=O)OC

DOS

IR

Vibrations