Geometry & MOs

Info

ID:	203994
PubChem CID:	79897678
Reduced:	ON2C16H24 (1)
Stoich.:	AB2C16D24 (1)
Weight, g/mol:	281.246713
ΔH_f, kcal/mol:	-25.59
Dipole, Da:	2.39
IP(EA), eV:	-8.05(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(5-oxaspiro[3.5]nonan-8-yl)piperazin-1-yl]butan-1-amine

Drug info:

PubChemData

Smile

CN(C1CCOC2(C1)CCC2)C3=CC=CC(=C3)CN

DOS

IR

Vibrations