Geometry & MOs

Info

ID:	134872
PubChem CID:	51772840
Reduced:	N2O3C30H34 (1)
Stoich.:	A2B3C30D34 (1)
Weight, g/mol:	418.210387
ΔH_f, kcal/mol:	-71.05
Dipole, Da:	8.01
IP(EA), eV:	-9.15(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[(1R)-2-oxo-1-(2,4,6-trihydroxyphenyl)-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CN([C@@H](C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)NC3CCCCC3)C(=O)C4=CC=C(C=C4)OC

DOS

IR

Vibrations