Geometry & MOs

Info

ID:	357448
PubChem CID:	127294081
Reduced:	O4N5C20H23 (1)
Stoich.:	A4B5C20D23 (1)
Weight, g/mol:	387.125277
ΔH_f, kcal/mol:	-92.24
Dipole, Da:	6.81
IP(EA), eV:	-8.5(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC2=NN=C(N2C1)CCNC(=O)C3CCN(C3=O)C4=CC5=C(C=C4)OCCO5

DOS

IR

Vibrations