Geometry & MOs

Info

ID:	293322
PubChem CID:	117384386
Reduced:	FON2C14H21 (1)
Stoich.:	ABC2D14E21 (1)
Weight, g/mol:	252.163791
ΔH_f, kcal/mol:	-83.42
Dipole, Da:	3.67
IP(EA), eV:	-8.68(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2-fluoro-6-methoxy-3-methylphenyl)ethyl]piperazine

Drug info:

PubChemData

Smile

CC(C1=C(C=CC(=C1)CCN2CCNCC2)O)F

DOS

IR

Vibrations