Geometry & MOs

Info

ID:	232734
PubChem CID:	87576841
Reduced:	N3O3C11H23 (1)
Stoich.:	A3B3C11D23 (1)
Weight, g/mol:	245.173942
ΔH_f, kcal/mol:	-124.49
Dipole, Da:	1.75
IP(EA), eV:	-9.41(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[2-[hydroxy(propyl)amino]-2-oxoethyl]-4-methylpentanamide

Drug info:

PubChemData

Smile

CCCN[C@@H](CC(C)C)C(=O)NCC(=O)NO

DOS

IR

Vibrations