Geometry & MOs

Info

ID:	1866
PubChem CID:	5232
Reduced:	SN2O4C10H18 (1)
Stoich.:	AB2C4D10E18 (1)
Weight, g/mol:	262.098728
ΔH_f, kcal/mol:	-150.11
Dipole, Da:	4.3
IP(EA), eV:	-9.54(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-3-nitrososulfanyl-2-(pentanoylamino)butanoic acid

Drug info:

PubChemData

Smile

CCCCC(=O)NC(C(=O)O)C(C)(C)SN=O

DOS

IR

Vibrations