Geometry & MOs

Info

ID:	373251
PubChem CID:	131312254
Reduced:	NO2C13H21 (1)
Stoich.:	AB2C13D21 (1)
Weight, g/mol:	270.98441
ΔH_f, kcal/mol:	-106.31
Dipole, Da:	5.42
IP(EA), eV:	-9.07(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 8-bromo-5-oxo-2,3-dihydro-1H-indolizine-6-carboxylate

Drug info:

PubChemData

Smile

CC(C)C1=C(N(C(=C1)C(C)(C)C)C)C(=O)O

DOS

IR

Vibrations