Geometry & MOs

Info

ID:	369806
PubChem CID:	127335761
Reduced:	OS2N4C19H20 (1)
Stoich.:	AB2C4D19E20 (1)
Weight, g/mol:	385.146013
ΔH_f, kcal/mol:	42.08
Dipole, Da:	4.43
IP(EA), eV:	-8.56(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(N(C1)CC(=O)NC2=NC3=C(S2)CCC3)C4=NC5=CC=CC=C5S4

DOS

IR

Vibrations