Geometry & MOs

Info

ID:	327763
PubChem CID:	126691000
Reduced:	O5C17H19 (2)
Stoich.:	A5B17C19 (2)
Weight, g/mol:	363.125277
ΔH_f, kcal/mol:	-305.45
Dipole, Da:	3.91
IP(EA), eV:	-8.4(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[3-(4-ethanehydrazonoylphenoxy)propyl]oxiran-2-yl]oxy-5-sulfanylidenepyrrolidin-2-one

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)C(C2=C(C=C(C(=C2)OC)COC3=CC=CC(=C3C(C4=C(C=CC=C4OC)OC)O)OC)OC)O

DOS

IR

Vibrations