Geometry & MOs

Info

ID:	388686
PubChem CID:	134989876
Reduced:	BrNOH8C10 (1)
Stoich.:	ABCD8E10 (1)
Weight, g/mol:	242.105528
ΔH_f, kcal/mol:	-17.1
Dipole, Da:	4.99
IP(EA), eV:	-8.74(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-phenyl-1H-imidazol-5-yl)pentane-1,2-dione

Drug info:

PubChemData

Smile

CC1=CC2=CC(=O)NC(=C2C=C1)Br

DOS

IR

Vibrations