Geometry & MOs

Info

ID:	222444
PubChem CID:	85300748
Reduced:	NO5C17H31 (1)
Stoich.:	AB5C17D31 (1)
Weight, g/mol:	329.081871
ΔH_f, kcal/mol:	-286.04
Dipole, Da:	1.18
IP(EA), eV:	-9.88(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-chlorophenyl)-(2-hydroxyanilino)methyl]-4-methyl-2H-furan-5-one

Drug info:

PubChemData

Smile

CCOC(=O)C(C(CC1CCCCC1)NC(=O)OC(C)(C)C)O

DOS

IR

Vibrations