Geometry & MOs

Info

ID:	360479
PubChem CID:	127301124
Reduced:	SO2N5C17H17 (1)
Stoich.:	AB2C5D17E17 (1)
Weight, g/mol:	373.120861
ΔH_f, kcal/mol:	31.15
Dipole, Da:	2.5
IP(EA), eV:	-8.56(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-cyano-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)-3-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)propanamide

Drug info:

PubChemData

Smile

C1COCCN1C2=CC=C(C=C2)C(=O)NC3=C(N4CCSC4=N3)C#N

DOS

IR

Vibrations