Geometry & MOs

Info

ID:	344529
PubChem CID:	127268113
Reduced:	ON2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	390.208947
ΔH_f, kcal/mol:	-68.86
Dipole, Da:	8.16
IP(EA), eV:	-8.91(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(=O)N2CCN(CC2)CCC3=NC(=O)C4=CC=CC=C4N3

DOS

IR

Vibrations