Geometry & MOs

Info

ID:	296372
PubChem CID:	117570541
Reduced:	N3C14H23 (1)
Stoich.:	A3B14C23 (1)
Weight, g/mol:	237.164126
ΔH_f, kcal/mol:	13.26
Dipole, Da:	2.52
IP(EA), eV:	-8.13(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-[2-(1-methylpiperazin-2-yl)ethyl]aniline

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NCCC2CN(CCN2)C

DOS

IR

Vibrations