Geometry & MOs

Info

ID:	31510
PubChem CID:	855807
Reduced:	SO2N4H16C17 (1)
Stoich.:	AB2C4D16E17 (1)
Weight, g/mol:	255.100777
ΔH_f, kcal/mol:	21.63
Dipole, Da:	1.12
IP(EA), eV:	-8.75(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-N,N-dimethylaniline

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)[C@H](C)SC2=NN=C(O2)C3=CN=CC=C3

DOS

IR

Vibrations