Geometry & MOs

Info

ID:	240805
PubChem CID:	93617641
Reduced:	SN2O3C15H18 (1)
Stoich.:	AB2C3D15E18 (1)
Weight, g/mol:	226.077599
ΔH_f, kcal/mol:	-79.96
Dipole, Da:	3.72
IP(EA), eV:	-9.08(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[[(2S)-oxolan-2-yl]methyl]-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C[C@H]1CN(C[C@@H](O1)C)C(=O)C2=C(OC(=N2)C3=CC=CS3)C

DOS

IR

Vibrations