Geometry & MOs

Info

ID:	419811
PubChem CID:	135109131
Reduced:	NF2O3C17H21 (1)
Stoich.:	AB2C3D17E21 (1)
Weight, g/mol:	314.174276
ΔH_f, kcal/mol:	-220.16
Dipole, Da:	5.76
IP(EA), eV:	-9.08(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methylimidazo[1,2-a]pyridin-2-yl)-[(1S,5S)-7-methyl-3-oxa-7,9-diazabicyclo[3.3.2]decan-9-yl]methanone

Drug info:

PubChemData

Smile

C1C[C@H]([C@]2(C1)CCCN(C2)CC3=CC4=C(C=C3)OC(O4)(F)F)O

DOS

IR

Vibrations