Geometry & MOs

Info

ID:	27173
PubChem CID:	818608
Reduced:	BrO5H9C10 (1)
Stoich.:	AB5C9D10 (1)
Weight, g/mol:	187.063329
ΔH_f, kcal/mol:	-157.52
Dipole, Da:	2.73
IP(EA), eV:	-9.5(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylindolizine-1,3-dicarbaldehyde

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1)C=O)Br)OCC(=O)O

DOS

IR

Vibrations