Geometry & MOs

Info

ID:	199941
PubChem CID:	79321346
Reduced:	BrNSO2C11H12 (1)
Stoich.:	ABCD2E11F12 (1)
Weight, g/mol:	271.23
ΔH_f, kcal/mol:	-74.78
Dipole, Da:	3.23
IP(EA), eV:	-9.61(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-benzyl-3-azaspiro[5.7]tridecane

Drug info:

PubChemData

Smile

CCC1C(CC(=O)NC1=O)C2=CC(=CS2)Br

DOS

IR

Vibrations