Geometry & MOs

Info

ID:	189853
PubChem CID:	77915263
Reduced:	ClNO3C26H32 (1)
Stoich.:	ABC3D26E32 (1)
Weight, g/mol:	311.130363
ΔH_f, kcal/mol:	-133.64
Dipole, Da:	5.36
IP(EA), eV:	-9.13(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-4-methylsulfanyl-2-(2-phenylethylcarbamoylamino)butanamide

Drug info:

PubChemData

Smile

CCC1C(CC2(C(C1C=CC3=NC=C(C=C3)C4=CC=CC(=C4)C)C(OC2=O)C)O)C.Cl

DOS

IR

Vibrations