Geometry & MOs

Info

ID:	32546
PubChem CID:	7843046
Reduced:	NO2H11C12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	329.162708
ΔH_f, kcal/mol:	-71.37
Dipole, Da:	4.15
IP(EA), eV:	-8.91(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[(2R)-3-methylbutan-2-yl]amino]-2-oxoethyl] 2-naphthalen-2-yloxyacetate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N(CCC#N)C(=O)COC(=O)COC2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations