Geometry & MOs

Info

ID:	174173
PubChem CID:	75734459
Reduced:	SN2O7C24H32 (1)
Stoich.:	AB2C7D24E32 (1)
Weight, g/mol:	406.246772
ΔH_f, kcal/mol:	-288.76
Dipole, Da:	9.25
IP(EA), eV:	-9.49(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclohexylamino)-2-oxo-1-(2,4,6-trihydroxyphenyl)ethyl]-N-propylpentanamide

Drug info:

PubChemData

Smile

CCCCC(=O)N(CCC)C(C1=C(C=C(C=C1O)O)O)C(=O)NCS(=O)(=O)C2=CC=C(C=C2)C

DOS

IR

Vibrations