Geometry & MOs

Info

ID:	276366
PubChem CID:	103822565
Reduced:	BrN2O2C9H11 (1)
Stoich.:	AB2C2D9E11 (1)
Weight, g/mol:	278.126657
ΔH_f, kcal/mol:	-68.37
Dipole, Da:	2.46
IP(EA), eV:	-10.19(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,4-dioxa-9-azaspiro[4.5]decane-9-carbonyl)-1-methylpyridin-2-one

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=CC(=NC=C1)Br)O

DOS

IR

Vibrations