Geometry & MOs

Info

ID:	293636
PubChem CID:	117394696
Reduced:	N2C17H24 (1)
Stoich.:	A2B17C24 (1)
Weight, g/mol:	256.193949
ΔH_f, kcal/mol:	3.27
Dipole, Da:	1.41
IP(EA), eV:	-7.86(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-5-(piperidin-4-ylmethyl)-1,3-dihydroisoindole

Drug info:

PubChemData

Smile

CC1=C(N(C2=C1C=CC(=C2)CC3CCCNC3)C)C

DOS

IR

Vibrations