Geometry & MOs

Info

ID:	344524
PubChem CID:	127268108
Reduced:	ON2C11H19 (2)
Stoich.:	AB2C11D19 (2)
Weight, g/mol:	352.193297
ΔH_f, kcal/mol:	-106.53
Dipole, Da:	2.46
IP(EA), eV:	-8.94(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexyl-1-[4-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(=O)N2CCN(CC2)CC(=O)NC3CCN(CC3)C4CC4

DOS

IR

Vibrations