Geometry & MOs

Info

ID:	380849
PubChem CID:	134971423
Reduced:	O3C17H18 (1)
Stoich.:	A3B17C18 (1)
Weight, g/mol:	283.157229
ΔH_f, kcal/mol:	-74.7
Dipole, Da:	2.59
IP(EA), eV:	-9.79(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R,3R,4R)-3-acetyl-N-[(1R)-1-phenylethyl]bicyclo[2.2.1]hept-5-ene-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)[C@@H]1[C@@H]2C[C@H]([C@H]1C(=O)OCC3=CC=CC=C3)C=C2

DOS

IR

Vibrations