Geometry & MOs

Info

ID:	73851
PubChem CID:	48420709
Reduced:	N3O4H19C23 (1)
Stoich.:	A3B4C19D23 (1)
Weight, g/mol:	354.103814
ΔH_f, kcal/mol:	-88.52
Dipole, Da:	3.04
IP(EA), eV:	-9.79(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[phenyl(pyridin-4-yl)methyl] 2-(4,5-dimethyl-2-oxo-1,3-thiazol-3-yl)acetate

Drug info:

PubChemData

Smile

CCN1C(=O)C2=C(C=C(C=C2)C(=O)OC(C3=CC=CC=C3)C4=CC=NC=C4)NC1=O

DOS

IR

Vibrations