Geometry & MOs

Info

ID:	417721
PubChem CID:	135102557
Reduced:	N3O3C21H29 (1)
Stoich.:	A3B3C21D29 (1)
Weight, g/mol:	310.225643
ΔH_f, kcal/mol:	-98.61
Dipole, Da:	2.54
IP(EA), eV:	-7.85(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-hydroxy-1-methylpiperidin-4-yl)-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC(=NC2=C1C=C(C=C2OC)OC)NCC3CC4(CCNCC4)CO3

DOS

IR

Vibrations