Geometry & MOs

Info

ID:	304766
PubChem CID:	124766151
Reduced:	N2O4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	368.173607
ΔH_f, kcal/mol:	-149.97
Dipole, Da:	6.04
IP(EA), eV:	-9.27(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,3S,6S,7R,9R)-5-oxo-N-[3-(piperidine-1-carbonyl)phenyl]-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)C2=CC(=CC=C2)NC(=O)[C@@H]3[C@@H]4C[C@@H]5[C@H]3C(=O)O[C@@H]5C4

DOS

IR

Vibrations