Geometry & MOs

Info

ID:	366683
PubChem CID:	127320212
Reduced:	ON7C18H27 (1)
Stoich.:	AB7C18D27 (1)
Weight, g/mol:	386.223038
ΔH_f, kcal/mol:	21.7
Dipole, Da:	4.48
IP(EA), eV:	-8.82(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CCC(C1)N2C(=CC=N2)NC(=O)CN3CCN(CC3)CC4=NC=CN4

DOS

IR

Vibrations