Geometry & MOs

Info

ID:	244589
PubChem CID:	99368079
Reduced:	N2O3H24C25 (1)
Stoich.:	A2B3C24D25 (1)
Weight, g/mol:	405.09396
ΔH_f, kcal/mol:	-56.42
Dipole, Da:	5.35
IP(EA), eV:	-8.53(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(2-bromo-4-methylphenoxy)-N-[(2-hydroxyphenyl)methyl]-N-propylpropanamide

Drug info:

PubChemData

Smile

CCCN(CC1=CC=CC=C1O)C(=O)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42

DOS

IR

Vibrations