Geometry & MOs

Info

ID:	203287
PubChem CID:	79808410
Reduced:	NSO2C15H23 (1)
Stoich.:	ABC2D15E23 (1)
Weight, g/mol:	257.062283
ΔH_f, kcal/mol:	-104.61
Dipole, Da:	2.09
IP(EA), eV:	-9.24(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(4-methylthiophen-3-yl)-1,2,4-oxadiazol-3-yl]aniline

Drug info:

PubChemData

Smile

CC1=CSC=C1C(=O)NCC2(CCC(CC2)(C)C)O

DOS

IR

Vibrations