Geometry & MOs

Info

ID:	209840
PubChem CID:	80730442
Reduced:	S2N4O5C10H16 (1)
Stoich.:	A2B4C5D10E16 (1)
Weight, g/mol:	347.022133
ΔH_f, kcal/mol:	-124.1
Dipole, Da:	10.57
IP(EA), eV:	-9.49(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(ethylamino)-N-methyl-4-nitro-N-(2,2,2-trifluoroethyl)thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CCNC1=C(C=C(S1)S(=O)(=O)NCCCC(=O)N)[N+](=O)[O-]

DOS

IR

Vibrations