Geometry & MOs

Info

ID:	187274
PubChem CID:	77553101
Reduced:	O2N5C15H19 (1)
Stoich.:	A2B5C15D19 (1)
Weight, g/mol:	435.159266
ΔH_f, kcal/mol:	18.71
Dipole, Da:	1.19
IP(EA), eV:	-9.01(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzofuran-2-yl)-5-(3-piperidin-4-ylpyrazolidin-4-yl)pyridin-2-amine;dihydrochloride

Drug info:

PubChemData

Smile

CN1C(=CC=N1)N(C)CC2=CC3=C(C=C2)N(C(=O)C(C3)N)O

DOS

IR

Vibrations