Geometry & MOs

Info

ID:	269587
PubChem CID:	103618061
Reduced:	N2O3C14H20 (1)
Stoich.:	A2B3C14D20 (1)
Weight, g/mol:	346.98269
ΔH_f, kcal/mol:	-117.84
Dipole, Da:	4.34
IP(EA), eV:	-9.48(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(1,1-dioxothian-4-yl)-2-hydroxybenzamide

Drug info:

PubChemData

Smile

CC(CN(C)C(=O)NCC1=CC=CC=C1)C(=O)OC

DOS

IR

Vibrations