Geometry & MOs

Info

ID:	150673
PubChem CID:	53790367
Reduced:	NOC20H41 (1)
Stoich.:	ABC20D41 (1)
Weight, g/mol:	469.048378
ΔH_f, kcal/mol:	-147.32
Dipole, Da:	4.32
IP(EA), eV:	-9.2(1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dichlorophenyl) 3-(2-amino-4-hydroxy-5-phenylfuran-3-yl)-5-methoxybenzoate

Drug info:

PubChemData

Smile

CCCCCCCCCN(CCCCCCCCC)C(=O)C

DOS

IR

Vibrations