Geometry & MOs

Info

ID:	209775
PubChem CID:	80720648
Reduced:	ON2C15H28 (1)
Stoich.:	AB2C15D28 (1)
Weight, g/mol:	233.141579
ΔH_f, kcal/mol:	-53.06
Dipole, Da:	2.61
IP(EA), eV:	-8.45(2.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-oxabicyclo[2.2.1]heptan-2-yl)-4,5,6,7-tetrahydroindol-4-ol

Drug info:

PubChemData

Smile

CCC1CCN(CC(CN1)C)C2CC3CCC2O3

DOS

IR

Vibrations