Geometry & MOs

Info

ID:	420075
PubChem CID:	135111001
Reduced:	O3N4C15H16 (1)
Stoich.:	A3B4C15D16 (1)
Weight, g/mol:	277.142641
ΔH_f, kcal/mol:	-60.79
Dipole, Da:	5.9
IP(EA), eV:	-9.83(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4aR,6R,7aR)-2-methyl-3-oxo-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyridin-6-yl]-N-methyl-1,2-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

C1[C@H]([C@@H](CO1)NC(=O)C2=CN=CC(=O)N2)CC3=CC=NC=C3

DOS

IR

Vibrations