Geometry & MOs

Info

ID:	78555
PubChem CID:	49693603
Reduced:	SN3O4C16H19 (1)
Stoich.:	AB3C4D16E19 (1)
Weight, g/mol:	299.072848
ΔH_f, kcal/mol:	-90.05
Dipole, Da:	10.95
IP(EA), eV:	-8.96(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[5-(thiophen-2-ylmethyl)-1,3,4-oxadiazol-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=CC(=NO3)C

DOS

IR

Vibrations