Geometry & MOs

Info

ID:	261617
PubChem CID:	103242300
Reduced:	SN2O3C12H14 (1)
Stoich.:	AB2C3D12E14 (1)
Weight, g/mol:	253.052112
ΔH_f, kcal/mol:	-73.56
Dipole, Da:	6.57
IP(EA), eV:	-9.54(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[(4-methyl-1,3-thiazol-2-yl)methylamino]methyl]-1,2-oxazole-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(OC(=C1)CNCC2=NC(=CS2)C)C(=O)O

DOS

IR

Vibrations