Geometry & MOs

Info

ID:	180229
PubChem CID:	76602236
Reduced:	O3C8H14 (1)
Stoich.:	A3B8C14 (1)
Weight, g/mol:	536.11095
ΔH_f, kcal/mol:	-147.15
Dipole, Da:	3.22
IP(EA), eV:	-10.33(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[[2-[[3-(1-methoxypropan-2-yloxy)-5-(thiophen-2-ylmethoxy)benzoyl]amino]-1,3-thiazol-5-yl]sulfanyl]propanoate

Drug info:

PubChemData

Smile

CC(C)C(=O)OC(C(=C)C)O

DOS

IR

Vibrations