Geometry & MOs

Info

ID:	407123
PubChem CID:	135079361
Reduced:	O3C13H18 (1)
Stoich.:	A3B13C18 (1)
Weight, g/mol:	199.157229
ΔH_f, kcal/mol:	-85.7
Dipole, Da:	1.99
IP(EA), eV:	-9.56(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N,N-diethyl-2,4-dimethyl-3-oxopentanamide

Drug info:

PubChemData

Smile

CC[C@@H](C1CO1)OCOCC2=CC=CC=C2

DOS

IR

Vibrations