Geometry & MOs

Info

ID:	358355
PubChem CID:	127295900
Reduced:	F2O2N3C18H23 (1)
Stoich.:	A2B2C3D18E23 (1)
Weight, g/mol:	344.209993
ΔH_f, kcal/mol:	-167.19
Dipole, Da:	2.76
IP(EA), eV:	-8.82(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7-hydroxy-2,2-dimethyl-3H-1-benzofuran-6-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

C1CCN(CC1)C2CCN(C2)C(=O)CNC(=O)C3=C(C=C(C=C3)F)F

DOS

IR

Vibrations