Geometry & MOs

Info

ID:	283659
PubChem CID:	103996325
Reduced:	ClSN2O3C14H19 (1)
Stoich.:	ABC2D3E14F19 (1)
Weight, g/mol:	430.90179
ΔH_f, kcal/mol:	-132.58
Dipole, Da:	7.22
IP(EA), eV:	-9.75(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[(2-hydroxyphenyl)methyl]-5-iodobenzamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(C(=O)O)NC(=O)NCCC2=CC=C(S2)Cl

DOS

IR

Vibrations