Geometry & MOs

Info

ID:	168726
PubChem CID:	75009567
Reduced:	O3N4C26H36 (1)
Stoich.:	A3B4C26D36 (1)
Weight, g/mol:	284.152478
ΔH_f, kcal/mol:	-100.21
Dipole, Da:	1.85
IP(EA), eV:	-8.24(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-(4-hydroxy-2,6-dimethylphenyl)-N-phenylpropanamide

Drug info:

PubChemData

Smile

CC(C)(C(=O)NC(CC1=CC=CC=C1)C(=O)NCCCN2CCOCC2)NC3=CC=CC=C3

DOS

IR

Vibrations