Geometry & MOs

Info

ID:	396548
PubChem CID:	135028725
Reduced:	BrON2H9C14 (1)
Stoich.:	ABC2D9E14 (1)
Weight, g/mol:	289.167794
ΔH_f, kcal/mol:	36.55
Dipole, Da:	3.68
IP(EA), eV:	-8.56(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-benzyl-8-oxa-2-azaspiro[4.5]decane-4-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=N)N(C2=O)C3=CC=CC=C3Br

DOS

IR

Vibrations