Geometry & MOs

Info

ID:	144187
PubChem CID:	53329047
Reduced:	NO4C13H17 (1)
Stoich.:	AB4C13D17 (1)
Weight, g/mol:	449.1223
ΔH_f, kcal/mol:	-159.7
Dipole, Da:	4.38
IP(EA), eV:	-8.84(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2Z)-2-[5-oxo-3,4-bis(phenylmethoxy)furan-2-ylidene]ethyl]-1,3,5-triazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CCCC(=O)NC1=C(C(=CC(=C1)C(=O)C)OC)O

DOS

IR

Vibrations