Geometry & MOs

Info

ID:	300160
PubChem CID:	121147426
Reduced:	SN4O4H12C15 (1)
Stoich.:	AB4C4D12E15 (1)
Weight, g/mol:	344.057926
ΔH_f, kcal/mol:	15.16
Dipole, Da:	3.58
IP(EA), eV:	-9.24(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=C(C=CS2)C3=NC(=NO3)C

DOS

IR

Vibrations