Geometry & MOs

Info

ID:	432947
PubChem CID:	135173084
Reduced:	SO2C9H12 (1)
Stoich.:	AB2C9D12 (1)
Weight, g/mol:	182.051384
ΔH_f, kcal/mol:	-74.25
Dipole, Da:	2.11
IP(EA), eV:	-8.97(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-(5-methyl-1,3-thiazol-2-yl)-4,5-dihydro-1,2-oxazole

Drug info:

PubChemData

Smile

CC1COC(O1)C2=CC=C(S2)C

DOS

IR

Vibrations