Geometry & MOs

Info

ID:	299221
PubChem CID:	117682122
Reduced:	BrN2C9H11 (1)
Stoich.:	AB2C9D11 (1)
Weight, g/mol:	263.179776
ΔH_f, kcal/mol:	34.49
Dipole, Da:	4.8
IP(EA), eV:	-9.39(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-(3-fluoropropyl)phenyl]piperazin-1-yl]ethanimine

Drug info:

PubChemData

Smile

CC(=NCC1=CC(=CC=C1)[76Br])N

DOS

IR

Vibrations