Geometry & MOs

Info

ID:	129665
PubChem CID:	51073497
Reduced:	SN2O4C16H16 (1)
Stoich.:	AB2C4D16E16 (1)
Weight, g/mol:	348.077993
ΔH_f, kcal/mol:	-52.5
Dipole, Da:	3.24
IP(EA), eV:	-8.83(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-(4-methoxyphenoxy)propan-2-ol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COCC(CSC2=NN=C(O2)C3=CC=CO3)O

DOS

IR

Vibrations