Geometry & MOs

Info

ID:	168837
PubChem CID:	75025776
Reduced:	N2O7C32H32 (1)
Stoich.:	A2B7C32D32 (1)
Weight, g/mol:	610.07395
ΔH_f, kcal/mol:	-152.97
Dipole, Da:	9.56
IP(EA), eV:	-9.13(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-bromophenyl)-3-[2-[5-oxo-3,4-bis(phenylmethoxy)furan-2-ylidene]ethyl]furo[2,3-d]pyrimidin-2-one

Drug info:

PubChemData

Smile

CCCCCC(C1=CC2=CN(C(=O)N=C2O1)CC=C3C(=C(C(=O)O3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)O

DOS

IR

Vibrations