Geometry & MOs

Info

ID:	262262
PubChem CID:	103280717
Reduced:	NSO2C16H23 (1)
Stoich.:	ABC2D16E23 (1)
Weight, g/mol:	329.06266
ΔH_f, kcal/mol:	-103.2
Dipole, Da:	5.15
IP(EA), eV:	-9.15(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(1-ethoxy-3-methylbutan-2-yl)-2-hydroxybenzamide

Drug info:

PubChemData

Smile

CC1CCC2=C(C1)SC=C2C(=O)NCC3CCC(C3)O

DOS

IR

Vibrations