Geometry & MOs

Info

ID:	283105
PubChem CID:	103958411
Reduced:	FNO4C19H20 (1)
Stoich.:	ABC4D19E20 (1)
Weight, g/mol:	234.209599
ΔH_f, kcal/mol:	-171.07
Dipole, Da:	3.54
IP(EA), eV:	-9.76(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1R)-1-aminopropyl]-N-methyl-N-(3-methylbutan-2-yl)aniline

Drug info:

PubChemData

Smile

CCC(C1=CC=CC=C1F)(C(=O)O)N(C)C(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations