Geometry & MOs

Info

ID:	57930
PubChem CID:	24278651
Reduced:	N3C13H13 (1)
Stoich.:	A3B13C13 (1)
Weight, g/mol:	218.141913
ΔH_f, kcal/mol:	63.32
Dipole, Da:	4.7
IP(EA), eV:	-8.45(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(oxolan-2-ylmethyl)-1,3-dihydroisoindol-4-amine

Drug info:

PubChemData

Smile

C1C2=C(CN1C3=CN=CC=C3)C(=CC=C2)N

DOS

IR

Vibrations