Geometry & MOs

Info

ID:	309258
PubChem CID:	126541255
Reduced:	OF3N3H12C16 (1)
Stoich.:	AB3C3D12E16 (1)
Weight, g/mol:	464.253589
ΔH_f, kcal/mol:	-80.13
Dipole, Da:	2.31
IP(EA), eV:	-8.55(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[3-[5-[1-(1-methylpiperidin-4-yl)azetidin-3-yl]-1,3,4-oxadiazol-2-yl]cyclobutyl]amino]-(3-phenyl-1,2-oxazol-5-yl)methanol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NCC2=C(C=C(C=C2)C3=NN=C(O3)C(F)F)F

DOS

IR

Vibrations