Geometry & MOs

Info

ID:	247616
PubChem CID:	103072423
Reduced:	OSN2C11H18 (1)
Stoich.:	ABC2D11E18 (1)
Weight, g/mol:	240.129634
ΔH_f, kcal/mol:	-39.44
Dipole, Da:	4.47
IP(EA), eV:	-8.62(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dimethyl-3-[2-(propylaminomethyl)prop-2-enyl]-1,3-thiazol-2-one

Drug info:

PubChemData

Smile

CCNCC(=C)CN1C(=C(SC1=O)C)C

DOS

IR

Vibrations