Geometry & MOs

Info

ID:	419846
PubChem CID:	135109355
Reduced:	FON5C11H14 (1)
Stoich.:	ABC5D11E14 (1)
Weight, g/mol:	371.166748
ΔH_f, kcal/mol:	0.64
Dipole, Da:	6.26
IP(EA), eV:	-8.79(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methylpyridin-3-yl)-[(1S,5R)-9-[(3-methylthiophen-2-yl)methyl]-3-oxa-7,9-diazabicyclo[3.3.2]decan-7-yl]methanone

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CN(C)C2=NC=C(C(=N2)OC)F

DOS

IR

Vibrations