Geometry & MOs

Info

ID:	327761
PubChem CID:	126690989
Reduced:	IN3H6C7 (1)
Stoich.:	AB3C6D7 (1)
Weight, g/mol:	323.200905
ΔH_f, kcal/mol:	70.33
Dipole, Da:	4.36
IP(EA), eV:	-8.6(-2.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(fluoromethoxy)-4-[[(3R)-3-methylpiperazin-1-yl]methyl]phenyl]morpholine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(N2I)N

DOS

IR

Vibrations