Geometry & MOs

Info

ID:	419638
PubChem CID:	135108573
Reduced:	N2F3C19H27 (1)
Stoich.:	A2B3C19D27 (1)
Weight, g/mol:	332.190006
ΔH_f, kcal/mol:	-154.19
Dipole, Da:	2.97
IP(EA), eV:	-8.64(-0.36)
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]-3-(3-fluorophenyl)-N-methylpropanamide

Drug info:

PubChemData

Smile

CN(C)C1C[C@@H]2CC(C[C@@H]2C1)N(C)CC3=CC=CC=C3C(F)(F)F

DOS

IR

Vibrations