Geometry & MOs

Info

ID:	420508
PubChem CID:	135113521
Reduced:	ON4C22H32 (1)
Stoich.:	AB4C22D32 (1)
Weight, g/mol:	301.204179
ΔH_f, kcal/mol:	-1.78
Dipole, Da:	4.05
IP(EA), eV:	-8.61(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5S)-7-[(3-prop-2-enoxyphenyl)methyl]-7-azaspiro[4.5]decan-4-ol

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC=C2)C)CN3CCC[C@]4([C@H]3CN(CC4)C)CO

DOS

IR

Vibrations