Geometry & MOs

Info

ID:	260073
PubChem CID:	103180027
Reduced:	N3O3C10H23 (1)
Stoich.:	A3B3C10D23 (1)
Weight, g/mol:	429.10122
ΔH_f, kcal/mol:	-97.01
Dipole, Da:	2.93
IP(EA), eV:	-8.88(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-iodo-4-[2-(3-methoxypropoxy)ethoxy]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CN(CCC(=NO)N)CCOCCCOC

DOS

IR

Vibrations