Geometry & MOs

Info

ID:	212093
PubChem CID:	81059463
Reduced:	ClON2C11H17 (1)
Stoich.:	ABC2D11E17 (1)
Weight, g/mol:	259.178358
ΔH_f, kcal/mol:	-34.83
Dipole, Da:	2.65
IP(EA), eV:	-8.49(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-dimethyl-5-[methyl(2-propan-2-yloxyethyl)amino]-5-oxopentanoic acid

Drug info:

PubChemData

Smile

CCOCCN(C)C1=C(C=C(C=C1)N)Cl

DOS

IR

Vibrations