Geometry & MOs

Info

ID:	147129
PubChem CID:	53786782
Reduced:	NO2C10H21 (1)
Stoich.:	AB2C10D21 (1)
Weight, g/mol:	257.173942
ΔH_f, kcal/mol:	-126.89
Dipole, Da:	1.94
IP(EA), eV:	-9.68(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]-N-methyl-2-(propanoylamino)propanamide

Drug info:

PubChemData

Smile

CCCCOC(=O)[C@H]([C@@H](C)CC)N

DOS

IR

Vibrations