Geometry & MOs

Info

ID:	206833
PubChem CID:	80307047
Reduced:	OSN3C12H21 (1)
Stoich.:	ABC3D12E21 (1)
Weight, g/mol:	306.103814
ΔH_f, kcal/mol:	-39.04
Dipole, Da:	4.14
IP(EA), eV:	-9.34(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,5-dimethyl-1,3-thiazol-2-yl)methyl 3-(4-aminophenoxy)propanoate

Drug info:

PubChemData

Smile

CCNC(=O)CNCC1=NC(=CS1)C(C)(C)C

DOS

IR

Vibrations