Geometry & MOs

Info

ID:	197278
PubChem CID:	78946596
Reduced:	FON2C14H21 (1)
Stoich.:	ABC2D14E21 (1)
Weight, g/mol:	266.179442
ΔH_f, kcal/mol:	-77.77
Dipole, Da:	1.42
IP(EA), eV:	-8.05(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[2-(4-ethyl-3-methylpiperazin-1-yl)-5-fluorophenyl]ethanol

Drug info:

PubChemData

Smile

CC1CN(CCN1C)C2=C(C=C(C=C2)[C@H](C)O)F

DOS

IR

Vibrations