Geometry & MOs

Info

ID:	26469
PubChem CID:	649513
Reduced:	SN2O2H8C12 (1)
Stoich.:	AB2C2D8E12 (1)
Weight, g/mol:	448.087512
ΔH_f, kcal/mol:	17.0
Dipole, Da:	4.27
IP(EA), eV:	-9.05(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(furan-2-ylmethyl)-2-[[5-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C(=CC2=C1)C3=NN=C(O3)S)O

DOS

IR

Vibrations