Geometry & MOs

Info

ID:	405797
PubChem CID:	135075459
Reduced:	INSO2H8C11 (1)
Stoich.:	ABCD2E8F11 (1)
Weight, g/mol:	251.071306
ΔH_f, kcal/mol:	-3.13
Dipole, Da:	2.71
IP(EA), eV:	-9.18(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3R)-7-chloro-3-ethenyl-2,3-dihydroindolizine-1-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=CC(=C(N=C1)C2=CC=CS2)I

DOS

IR

Vibrations