Geometry & MOs

Info

ID:	63707
PubChem CID:	26759019
Reduced:	NO5C16H23 (1)
Stoich.:	AB5C16D23 (1)
Weight, g/mol:	371.173273
ΔH_f, kcal/mol:	-209.83
Dipole, Da:	8.15
IP(EA), eV:	-8.91(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-oxo-1-(2-propan-2-ylanilino)propan-2-yl] 3,4-dimethoxybenzoate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC(C)(C)C)OC(=O)C1=CC(=C(C=C1)OC)OC

DOS

IR

Vibrations