Geometry & MOs

Info

ID:	63706
PubChem CID:	26759017
Reduced:	NO5C16H23 (1)
Stoich.:	AB5C16D23 (1)
Weight, g/mol:	309.157623
ΔH_f, kcal/mol:	-199.02
Dipole, Da:	2.05
IP(EA), eV:	-8.7(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(tert-butylamino)-1-oxopropan-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