Geometry & MOs

Info

ID:	261536
PubChem CID:	103238930
Reduced:	N2O5C14H16 (1)
Stoich.:	A2B5C14D16 (1)
Weight, g/mol:	278.039499
ΔH_f, kcal/mol:	-106.61
Dipole, Da:	8.38
IP(EA), eV:	-8.52(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-(methanesulfonamido)ethylamino]methyl]thiophene-2-carboxylic acid

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CNCC2=CC(=NO2)C(=O)O)OC

DOS

IR

Vibrations