Geometry & MOs

Info

ID:	366985
PubChem CID:	127322533
Reduced:	ON5C20H29 (1)
Stoich.:	AB5C20D29 (1)
Weight, g/mol:	294.194343
ΔH_f, kcal/mol:	-16.23
Dipole, Da:	4.32
IP(EA), eV:	-8.68(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dioxan-2-ylmethyl)-2-azaspiro[5.5]undec-9-ene-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C2=NC=CC=N2)NC(=O)N3CCCC4(C3)CCC=CC4

DOS

IR

Vibrations