Geometry & MOs

Info

ID:	291990
PubChem CID:	114000494
Reduced:	NSO2C13H23 (1)
Stoich.:	ABC2D13E23 (1)
Weight, g/mol:	269.108565
ΔH_f, kcal/mol:	-68.52
Dipole, Da:	1.06
IP(EA), eV:	-8.51(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(2-methylfuran-3-yl)sulfanyl-1,4-dioxaspiro[4.5]decan-8-amine

Drug info:

PubChemData

Smile

CNC(CSCC1(CC1)CC(=O)OC)C2CC2

DOS

IR

Vibrations