Geometry & MOs

Info

ID:	270206
PubChem CID:	103634231
Reduced:	ClN4O4H9C12 (1)
Stoich.:	AB4C4D9E12 (1)
Weight, g/mol:	339.9551
ΔH_f, kcal/mol:	-9.02
Dipole, Da:	6.53
IP(EA), eV:	-9.65(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-bromothiophen-2-yl)sulfonylamino]-N-ethyl-N-methylacetamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(=O)NC2=NC=CN=C2Cl)[N+](=O)[O-]

DOS

IR

Vibrations