Geometry & MOs

Info

ID:	371378
PubChem CID:	127346055
Reduced:	NOC8H14 (2)
Stoich.:	ABC8D14 (2)
Weight, g/mol:	241.167794
ΔH_f, kcal/mol:	-129.44
Dipole, Da:	6.95
IP(EA), eV:	-9.13(1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-dioxan-2-yl-(2-ethylazepan-1-yl)methanone

Drug info:

PubChemData

Smile

CCC1CCCCCN1C(=O)C2CCN(CC2)C(=O)C

DOS

IR

Vibrations