Geometry & MOs

Info

ID:	315054
PubChem CID:	126624296
Reduced:	NO4C8H13 (1)
Stoich.:	AB4C8D13 (1)
Weight, g/mol:	399.298473
ΔH_f, kcal/mol:	-191.9
Dipole, Da:	5.5
IP(EA), eV:	-10.37(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-O-tert-butyl 1-O-(2,5,5,7,7-pentamethyl-6-oxooctan-2-yl) 2-aminopentanedioate

Drug info:

PubChemData

Smile

CCC(=O)C[C@@H](C(=O)O)NC(=O)C

DOS

IR

Vibrations