Geometry & MOs

Info

ID:	168582
PubChem CID:	74990186
Reduced:	NSO8H15C16 (1)
Stoich.:	ABC8D15E16 (1)
Weight, g/mol:	426.226705
ΔH_f, kcal/mol:	-272.73
Dipole, Da:	5.21
IP(EA), eV:	-9.35(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(benzylamino)-1-oxo-3-pyridin-3-ylpropan-2-yl]-N'-hydroxy-2-(2-methylpropyl)butanediamide

Drug info:

PubChemData

Smile

CC(C1C2N(C1=O)C(=C(S2)COC(=O)C3=CC(=C(C=C3)O)O)C(=O)O)O

DOS

IR

Vibrations