Geometry & MOs

Info

ID:	137258
PubChem CID:	52178464
Reduced:	ClSN4O4C14H15 (1)
Stoich.:	ABC4D4E14F15 (1)
Weight, g/mol:	384.071468
ΔH_f, kcal/mol:	-42.55
Dipole, Da:	9.86
IP(EA), eV:	-9.6(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-[(1-methylimidazol-2-yl)methoxy]phenyl]methylsulfanyl]-5-thiophen-2-yl-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN=C(O1)SCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

DOS

IR

Vibrations