Geometry & MOs

Info

ID:	344468
PubChem CID:	127267644
Reduced:	FO3N4C20H25 (1)
Stoich.:	AB3C4D20E25 (1)
Weight, g/mol:	388.191069
ΔH_f, kcal/mol:	-93.03
Dipole, Da:	2.7
IP(EA), eV:	-9.49(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-fluorophenyl)oxan-4-yl]-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN2CCN(CC2)C(=O)C3(CCOCC3)C4=CC(=CC=C4)F

DOS

IR

Vibrations