Geometry & MOs

Info

ID:	392117
PubChem CID:	135013064
Reduced:	N3O5C12H15 (1)
Stoich.:	A3B5C12D15 (1)
Weight, g/mol:	352.01984
ΔH_f, kcal/mol:	-149.24
Dipole, Da:	4.03
IP(EA), eV:	-9.11(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-iodo-1-methyl-3-phenyl-2,3-dihydroindolizin-4-ium-1-ol

Drug info:

PubChemData

Smile

COC1=CC=NC2=C(NN=C12)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O

DOS

IR

Vibrations