Geometry & MOs

Info

ID:	358979
PubChem CID:	127296870
Reduced:	O2N4C11H12 (1)
Stoich.:	A2B4C11D12 (1)
Weight, g/mol:	378.194343
ΔH_f, kcal/mol:	-8.01
Dipole, Da:	3.45
IP(EA), eV:	-9.19(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzoyl-N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1COCC1C(=O)NC2=CC=NC3=CC=NN32

DOS

IR

Vibrations