Geometry & MOs

Info

ID:	29506
PubChem CID:	834550
Reduced:	SN2C15H22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	229.126678
ΔH_f, kcal/mol:	19.84
Dipole, Da:	3.39
IP(EA), eV:	-8.5(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-fluorophenyl)methyl]-3,4-dimethylaniline

Drug info:

PubChemData

Smile

CSC1=CC=C(C=C1)CN[C@H]2CN3CCC2CC3

DOS

IR

Vibrations