Geometry & MOs

Info

ID:	69441
PubChem CID:	47170073
Reduced:	ON3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	372.98058
ΔH_f, kcal/mol:	-21.7
Dipole, Da:	2.64
IP(EA), eV:	-9.38(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CN(C1C2CC3CC(C2)CC1C3)C(=O)CN4C=CC=N4

DOS

IR

Vibrations