Geometry & MOs

Info

ID:	209981
PubChem CID:	80747072
Reduced:	NF2O3H9C13 (1)
Stoich.:	AB2C3D9E13 (1)
Weight, g/mol:	332.991169
ΔH_f, kcal/mol:	-169.22
Dipole, Da:	4.3
IP(EA), eV:	-10.11(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-N-[(4-methylthiophen-3-yl)methyl]-4-nitrothiophene-2-sulfonamide

Drug info:

PubChemData

Smile

C1COCC2=C(C3=CC(=C(C=C3N=C21)F)F)C(=O)O

DOS

IR

Vibrations