Geometry & MOs

Info

ID:	192876
PubChem CID:	78321840
Reduced:	OF2N5C19H21 (1)
Stoich.:	AB2C5D19E21 (1)
Weight, g/mol:	365.185175
ΔH_f, kcal/mol:	-72.47
Dipole, Da:	2.65
IP(EA), eV:	-8.51(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-(5-propan-2-yloxy-1H-indazol-3-yl)pyrimidin-4-yl]-8-oxa-3-azabicyclo[3.2.1]octane

Drug info:

PubChemData

Smile

CC(C)OC1=CC2=C(C=C1)NN=C2C3=CC(=NC=N3)N4CCC(CC4)(F)F

DOS

IR

Vibrations