Geometry & MOs

Info

ID:	296313
PubChem CID:	117567357
Reduced:	N2F3C13H19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	210.153227
ΔH_f, kcal/mol:	-162.72
Dipole, Da:	4.74
IP(EA), eV:	-8.6(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(3-fluorophenyl)-2,2-dimethylbutane-1,4-diamine

Drug info:

PubChemData

Smile

CC(C)(CCNC1=CC=CC(=C1)C(F)(F)F)CN

DOS

IR

Vibrations