Geometry & MOs

Info

ID:	38242
PubChem CID:	8028389
Reduced:	O3N4C14H14 (1)
Stoich.:	A3B4C14D14 (1)
Weight, g/mol:	426.251858
ΔH_f, kcal/mol:	-10.4
Dipole, Da:	8.87
IP(EA), eV:	-10.09(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2=NN=NN2[C@@H]3CC(=O)[C@@H]4OC[C@@H]3O4

DOS

IR

Vibrations