Geometry & MOs

Info

ID:	312174
PubChem CID:	126603453
Reduced:	NO3C12H23 (1)
Stoich.:	AB3C12D23 (1)
Weight, g/mol:	329.140927
ΔH_f, kcal/mol:	-159.41
Dipole, Da:	5.71
IP(EA), eV:	-8.65(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-(2-methylpropoxy)-2-[[methyl(1,3-thiazol-5-ylmethyl)carbamoyl]amino]butanoic acid

Drug info:

PubChemData

Smile

CCCC(C)N1CCO[C@H](C1)CCC(=O)O

DOS

IR

Vibrations