Geometry & MOs

Info

ID:	414708
PubChem CID:	135087667
Reduced:	FNO4C19H26 (1)
Stoich.:	ABC4D19E26 (1)
Weight, g/mol:	253.167794
ΔH_f, kcal/mol:	-237.55
Dipole, Da:	5.15
IP(EA), eV:	-9.57(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-(3-methyloxetan-3-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)F)CC(=O)N2CCC3(CC2)[C@H]([C@](CCO3)(C)O)O

DOS

IR

Vibrations