Geometry & MOs

Info

ID:	199419
PubChem CID:	79243581
Reduced:	FN3C16H20 (1)
Stoich.:	AB3C16D20 (1)
Weight, g/mol:	267.173548
ΔH_f, kcal/mol:	-0.61
Dipole, Da:	4.15
IP(EA), eV:	-8.45(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1,3-dihydroisoindol-2-ylmethyl)-N-propylpyridin-2-amine

Drug info:

PubChemData

Smile

CCNC1=CC=CC(=N1)CN(C)CC2=CC=C(C=C2)F

DOS

IR

Vibrations