Geometry & MOs

Info

ID:	361430
PubChem CID:	127303409
Reduced:	NSO4C17H23 (1)
Stoich.:	ABC4D17E23 (1)
Weight, g/mol:	377.086784
ΔH_f, kcal/mol:	-171.2
Dipole, Da:	3.39
IP(EA), eV:	-9.92(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)-1-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCOC(C1)CCC(=O)NC2CCS(=O)(=O)C3=CC=CC=C23

DOS

IR

Vibrations