Geometry & MOs

Info

ID:	268872
PubChem CID:	103601304
Reduced:	NSO4C15H21 (1)
Stoich.:	ABC4D15E21 (1)
Weight, g/mol:	227.224915
ΔH_f, kcal/mol:	-162.99
Dipole, Da:	7.26
IP(EA), eV:	-9.75(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[bis(3-methylbutyl)amino]butan-2-one

Drug info:

PubChemData

Smile

CCOC(=O)C(C1=CC=CC=C1)NC2(CCS(=O)(=O)C2)C

DOS

IR

Vibrations