Geometry & MOs

Info

ID:	134800
PubChem CID:	51758283
Reduced:	N2O5C27H38 (1)
Stoich.:	A2B5C27D38 (1)
Weight, g/mol:	470.278072
ΔH_f, kcal/mol:	-201.45
Dipole, Da:	5.2
IP(EA), eV:	-8.6(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-2-(butylamino)-1-(4-hydroxy-3-methoxyphenyl)-2-oxoethyl]-N-hexyl-4-methoxybenzamide

Drug info:

PubChemData

Smile

CCCCCCN([C@@H](C1=CC(=C(C=C1)O)OC)C(=O)NCCCC)C(=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations