Geometry & MOs

Info

ID:	417909
PubChem CID:	135103044
Reduced:	FNO4C21H24 (1)
Stoich.:	ABC4D21E24 (1)
Weight, g/mol:	277.179027
ΔH_f, kcal/mol:	-182.61
Dipole, Da:	3.56
IP(EA), eV:	-9.1(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-9-(5-propyl-1,2,4-oxadiazol-3-yl)-1-oxa-9-azaspiro[5.5]undec-4-ene

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)F)CN2CC[C@]([C@@H](C2)O)(CC3=CC=CC=C3)C(=O)O

DOS

IR

Vibrations