Geometry & MOs

Info

ID:	402419
PubChem CID:	135055906
Reduced:	NO3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	544.260708
ΔH_f, kcal/mol:	-156.39
Dipole, Da:	2.8
IP(EA), eV:	-9.42(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2,6-di(propan-2-yl)phenyl] (2S)-2-[(R)-[(2-methylpropan-2-yl)oxycarbonylamino]-(4-methylsulfanylphenyl)methyl]-2-nitrobutanoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@H](CCO)NC(=O)OC(C)(C)C

DOS

IR

Vibrations