Geometry & MOs

Info

ID:	418319
PubChem CID:	135104185
Reduced:	O2N4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-36.75
Dipole, Da:	3.71
IP(EA), eV:	-8.72(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-(2-cyclohexylethyl)-3-(pyridine-3-carbonyl)-7-oxa-3,11-diazaspiro[5.6]dodecan-10-one

Drug info:

PubChemData

Smile

CCC1=CC(=NC(=N1)N2CCOCC2)NC3CC4=CC=CC=C4OC3

DOS

IR

Vibrations