Geometry & MOs

Info

ID:	288948
PubChem CID:	104328857
Reduced:	FON2C16H23 (1)
Stoich.:	ABC2D16E23 (1)
Weight, g/mol:	277.15904
ΔH_f, kcal/mol:	-92.27
Dipole, Da:	4.95
IP(EA), eV:	-9.32(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-fluoro-2-methylphenyl)-(3-piperazin-1-ylazetidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C(=O)N(C)C2CCCCC2CN

DOS

IR

Vibrations