Geometry & MOs

Info

ID:	347647
PubChem CID:	127272513
Reduced:	N2O5C21H28 (1)
Stoich.:	A2B5C21D28 (1)
Weight, g/mol:	394.189257
ΔH_f, kcal/mol:	-206.39
Dipole, Da:	5.9
IP(EA), eV:	-8.67(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-hydroxy-2,2-dimethyl-3H-1-benzofuran-6-carbonyl)-N-phenylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1(CC2=C(O1)C(=C(C=C2)C(=O)N3CCC(CC3)C(=O)N4CCOCC4)O)C

DOS

IR

Vibrations