Geometry & MOs

Info

ID:	292009
PubChem CID:	114007806
Reduced:	N3O4C12H23 (1)
Stoich.:	A3B4C12D23 (1)
Weight, g/mol:	464.89288
ΔH_f, kcal/mol:	-197.88
Dipole, Da:	2.9
IP(EA), eV:	-8.73(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(6-iodohexyl)-2-methylthiophene-3-sulfonamide

Drug info:

PubChemData

Smile

CC1(CCN(CC1)C)CNC(=O)NC[C@@H](C(=O)O)O

DOS

IR

Vibrations