Geometry & MOs

Info

ID:	220324
PubChem CID:	85177297
Reduced:	NO5C11H19 (1)
Stoich.:	AB5C11D19 (1)
Weight, g/mol:	245.105193
ΔH_f, kcal/mol:	-219.8
Dipole, Da:	5.63
IP(EA), eV:	-9.84(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-benzyl-3-oxa-7-azabicyclo[3.3.1]nonane-2,4-dione

Drug info:

PubChemData

Smile

CC1C(C(C(C(O1)N(CC=C)C(=O)C)O)O)O

DOS

IR

Vibrations