Geometry & MOs

Info

ID:	197722
PubChem CID:	78989249
Reduced:	NSO2C11H21 (1)
Stoich.:	ABC2D11E21 (1)
Weight, g/mol:	233.047027
ΔH_f, kcal/mol:	-113.09
Dipole, Da:	4.18
IP(EA), eV:	-9.43(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(1-methylimidazol-4-yl)sulfonylamino]propanoic acid

Drug info:

PubChemData

Smile

CC(C)S(=O)(=O)N1CCC2C1CCCC2

DOS

IR

Vibrations