Geometry & MOs

Info

ID:	231138
PubChem CID:	87572739
Reduced:	NO2C12H23 (2)
Stoich.:	AB2C12D23 (2)
Weight, g/mol:	426.345758
ΔH_f, kcal/mol:	-269.82
Dipole, Da:	4.43
IP(EA), eV:	-9.85(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl (2S)-5-amino-2-(hexadecanoylamino)-5-oxopentanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC(=O)NC(=O)CCC(C(=O)OC(C)C)N

DOS

IR

Vibrations