Geometry & MOs

Info

ID:	374010
PubChem CID:	131322306
Reduced:	NC7H9 (2)
Stoich.:	AB7C9 (2)
Weight, g/mol:	181.126678
ΔH_f, kcal/mol:	29.42
Dipole, Da:	3.88
IP(EA), eV:	-9.07(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(2,4-dimethylphenyl)-3-fluoropropan-1-amine

Drug info:

PubChemData

Smile

C1CNCCC1CC2=CC=C(C=C2)CC#N

DOS

IR

Vibrations