Geometry & MOs

Info

ID:	442660
PubChem CID:	135254089
Reduced:	ON2C5H8 (1)
Stoich.:	AB2C5D8 (1)
Weight, g/mol:	632.278741
ΔH_f, kcal/mol:	30.49
Dipole, Da:	1.61
IP(EA), eV:	-9.21(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (5R)-1-oxo-2-(1-tritylindazol-5-yl)-2,7-diazaspiro[4.4]nonane-7-carboxylate

Drug info:

PubChemData

Smile

C1CNCC=C1N=O

DOS

IR

Vibrations