Geometry & MOs

Info

ID:	357685
PubChem CID:	127294359
Reduced:	OSN5C20H29 (1)
Stoich.:	ABC5D20E29 (1)
Weight, g/mol:	360.173231
ΔH_f, kcal/mol:	5.39
Dipole, Da:	4.29
IP(EA), eV:	-8.96(-0.06)
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-[4-(4-ethyl-1,2,4-triazol-3-yl)piperidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CCC1C2=C(CCN1C(=O)CN3CCC(CC3)C4=NN=CN4CC)SC=C2

DOS

IR

Vibrations