Geometry & MOs

Info

ID:	438351
PubChem CID:	135228084
Reduced:	N2O2H18C19 (1)
Stoich.:	A2B2C18D19 (1)
Weight, g/mol:	278.15518
ΔH_f, kcal/mol:	-2.49
Dipole, Da:	4.73
IP(EA), eV:	-8.47(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 1-[3-(2-hydroxypropan-2-yloxy)propyl]cyclopropane-1-sulfinate

Drug info:

PubChemData

Smile

CCCOC1=CC(=C2C3=CC=CC=C3C(C2=C1)O)C4=CNN=C4

DOS

IR

Vibrations