Geometry & MOs

Info

ID:	174357
PubChem CID:	75757681
Reduced:	N2O6C27H34 (1)
Stoich.:	A2B6C27D34 (1)
Weight, g/mol:	426.179087
ΔH_f, kcal/mol:	-209.24
Dipole, Da:	6.89
IP(EA), eV:	-8.83(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(butylamino)-1-(furan-2-yl)-2-oxoethyl]-2,3-dihydroxy-N-[(5-methylfuran-2-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CN(C(C2=CC=CO2)C(=O)NC(C)(C)CC(C)(C)C)C(=O)C3=C(C(=CC=C3)O)O

DOS

IR

Vibrations