Geometry & MOs

Info

ID:	410994
PubChem CID:	135083799
Reduced:	BrNO2H10C13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	132.112643
ΔH_f, kcal/mol:	22.58
Dipole, Da:	3.33
IP(EA), eV:	-9.03(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

lithium;(5E)-2-methylhepta-1,5-dien-3-olate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C(=C\2/C=C(C=CC2=O)Br)/NO

DOS

IR

Vibrations