Geometry & MOs

Info

ID:	278545
PubChem CID:	103836453
Reduced:	BrClSN2O3C12H18 (1)
Stoich.:	ABCD2E3F12G18 (1)
Weight, g/mol:	289.146013
ΔH_f, kcal/mol:	-110.83
Dipole, Da:	4.37
IP(EA), eV:	-10.24(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-N-[2-(2-hydroxyethyl)pentyl]imidazole-4-sulfonamide

Drug info:

PubChemData

Smile

CCCC(CCO)CNS(=O)(=O)C1=C(N=CC(=C1)Br)Cl

DOS

IR

Vibrations