Geometry & MOs

Info

ID:	420217
PubChem CID:	135111905
Reduced:	N2F3O3C19H23 (1)
Stoich.:	A2B3C3D19E23 (1)
Weight, g/mol:	305.210327
ΔH_f, kcal/mol:	-283.84
Dipole, Da:	3.16
IP(EA), eV:	-9.8(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-[methyl(pyridin-3-ylmethyl)amino]-N-(oxan-2-ylmethyl)acetamide

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)CC3=CC=CC=C3C(F)(F)F)C(=O)O

DOS

IR

Vibrations