Geometry & MOs

Info

ID:	303528
PubChem CID:	124489863
Reduced:	NO4C19H29 (1)
Stoich.:	AB4C19D29 (1)
Weight, g/mol:	335.209658
ΔH_f, kcal/mol:	-188.58
Dipole, Da:	3.37
IP(EA), eV:	-9.34(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[[(2S)-butan-2-yl]-[2-(2,6-dimethylphenoxy)acetyl]amino]propanoate

Drug info:

PubChemData

Smile

CC[C@@H](C)N(CCC(=O)OCC)C(=O)COC1=C(C=CC=C1C)C

DOS

IR

Vibrations