Geometry & MOs

Info

ID:	369809
PubChem CID:	127335764
Reduced:	S2O3N4C16H24 (1)
Stoich.:	A2B3C4D16E24 (1)
Weight, g/mol:	316.135782
ΔH_f, kcal/mol:	-98.18
Dipole, Da:	3.32
IP(EA), eV:	-8.53(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-(1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)acetamide

Drug info:

PubChemData

Smile

C1CC2=C(C1)SC(=N2)NC(=O)CN3CCN(CC3)C4CCS(=O)(=O)C4

DOS

IR

Vibrations