Geometry & MOs

Info

ID:	55363
PubChem CID:	17395291
Reduced:	O2N3C15H23 (1)
Stoich.:	A2B3C15D23 (1)
Weight, g/mol:	359.136887
ΔH_f, kcal/mol:	-70.18
Dipole, Da:	3.85
IP(EA), eV:	-8.85(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[4-(2-methylpropanoylamino)phenyl]-2-oxoethyl] 5-(hydroxymethyl)-2-methylfuran-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)NC(=O)N1CCN(CC1)C2=CC=CC=C2OC

DOS

IR

Vibrations