Geometry & MOs

Info

ID:	362491
PubChem CID:	127308030
Reduced:	N2O4C21H30 (1)
Stoich.:	A2B4C21D30 (1)
Weight, g/mol:	325.144471
ΔH_f, kcal/mol:	-170.33
Dipole, Da:	2.94
IP(EA), eV:	-8.74(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[3-[(2-chlorophenyl)methoxy]-2-hydroxypropyl]-8-azabicyclo[3.2.1]octan-3-ol

Drug info:

PubChemData

Smile

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)CN3C4CCC3CC(C4)O

DOS

IR

Vibrations