Geometry & MOs

Info

ID:	291789
PubChem CID:	113505592
Reduced:	O2N5C11H13 (1)
Stoich.:	A2B5C11D13 (1)
Weight, g/mol:	348.95543
ΔH_f, kcal/mol:	56.65
Dipole, Da:	10.11
IP(EA), eV:	-9.29(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[1-(1H-imidazol-2-yl)ethyl]-2-methylthiophene-3-sulfonamide

Drug info:

PubChemData

Smile

C1=CC(=NC=C1NCCCC2=NC=CN2)[N+](=O)[O-]

DOS

IR

Vibrations