Geometry & MOs

Info

ID:	358720
PubChem CID:	127296534
Reduced:	ON5C14H25 (1)
Stoich.:	AB5C14D25 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	29.71
Dipole, Da:	6.56
IP(EA), eV:	-9.41(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(4-propoxyazepan-1-yl)acetyl]spiro[1H-quinoxaline-3,1'-cyclopentane]-2-one

Drug info:

PubChemData

Smile

CCCOC1CCCN(CC1)CC2=NN=NN2C3CC3

DOS

IR

Vibrations