Geometry & MOs

Info

ID:	216398
PubChem CID:	85086162
Reduced:	NO2H13C17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	267.137162
ΔH_f, kcal/mol:	22.87
Dipole, Da:	4.14
IP(EA), eV:	-9.38(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2,3-dihydro-1-benzofuran-5-yl)pyrazolidin-3-yl]pyridine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)C=C(C#N)C2=CC=CC=C2

DOS

IR

Vibrations