Geometry & MOs

Info

ID:	416635
PubChem CID:	135089880
Reduced:	FNOC17H24 (1)
Stoich.:	ABCD17E24 (1)
Weight, g/mol:	396.11775
ΔH_f, kcal/mol:	-102.25
Dipole, Da:	2.14
IP(EA), eV:	-8.74(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[5-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]sulfonyl]thiophen-2-yl]-3-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)CN2CCC[C@@]3(C2)CCC[C@H]3O)F

DOS

IR

Vibrations