Geometry & MOs

Info

ID:	421994
PubChem CID:	135116979
Reduced:	NO3C19H27 (1)
Stoich.:	AB3C19D27 (1)
Weight, g/mol:	326.210661
ΔH_f, kcal/mol:	-135.91
Dipole, Da:	7.32
IP(EA), eV:	-8.6(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5S)-7-[5-(imidazol-1-ylmethyl)pyridin-2-yl]-4-methoxy-7-azaspiro[4.5]decane

Drug info:

PubChemData

Smile

CC[C@]1(CCC[C@H]2[C@@H]1CN(C2)C(=O)CC3=CC=C(C=C3)OC)O

DOS

IR

Vibrations