Geometry & MOs

Info

ID:	434608
PubChem CID:	135175343
Reduced:	NS2O3C10H21 (1)
Stoich.:	AB2C3D10E21 (1)
Weight, g/mol:	231.183444
ΔH_f, kcal/mol:	-130.46
Dipole, Da:	4.25
IP(EA), eV:	-8.86(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-2-methyl-4-[3-[2-(methylamino)ethoxy]propoxy]pentan-3-one

Drug info:

PubChemData

Smile

CC(C)C(=O)COCCOCCCNSS

DOS

IR

Vibrations