Geometry & MOs

Info

ID:	56239
PubChem CID:	17422764
Reduced:	NO2C17H23 (1)
Stoich.:	AB2C17D23 (1)
Weight, g/mol:	384.98058
ΔH_f, kcal/mol:	-68.96
Dipole, Da:	1.21
IP(EA), eV:	-9.68(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-methoxy-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]benzamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C(=O)CCC(=O)NC2CC2

DOS

IR

Vibrations