Geometry & MOs

Info

ID:	216155
PubChem CID:	85085809
Reduced:	O2N5C10H13 (1)
Stoich.:	A2B5C10D13 (1)
Weight, g/mol:	235.120843
ΔH_f, kcal/mol:	4.44
Dipole, Da:	3.44
IP(EA), eV:	-8.97(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

spiro[4,7-dioxa-6-azatricyclo[6.3.0.02,6]undec-9-ene-5,1'-cyclohexane]-3-one

Drug info:

PubChemData

Smile

C1C(COC1CO)N2N=C3C(=CC=NC3=N2)N

DOS

IR

Vibrations