Geometry & MOs

Info

ID:	367551
PubChem CID:	127324919
Reduced:	OSN5C20H27 (1)
Stoich.:	ABC5D20E27 (1)
Weight, g/mol:	306.205576
ΔH_f, kcal/mol:	16.45
Dipole, Da:	2.68
IP(EA), eV:	-8.53(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(4-methylcyclohexyl)piperazin-1-yl]-2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone

Drug info:

PubChemData

Smile

CC1CCC(CC1)N2CCN(CC2)C(=O)CC3=CSC(=N3)C4=NC=CN=C4

DOS

IR

Vibrations