Geometry & MOs

Info

ID:	220558
PubChem CID:	85197788
Reduced:	NSO6C14H19 (1)
Stoich.:	ABC6D14E19 (1)
Weight, g/mol:	329.162708
ΔH_f, kcal/mol:	-250.51
Dipole, Da:	3.93
IP(EA), eV:	-10.25(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-hydroxy-6-[(4-methoxyphenyl)methyl]-5-azatricyclo[6.3.1.01,5]dodecane-4,9-dione

Drug info:

PubChemData

Smile

CCOC(=O)C(C(C1=CC=C(C=C1)S(=O)(=O)C)O)NC(=O)C

DOS

IR

Vibrations