Geometry & MOs

Info

ID:	339511
PubChem CID:	127261444
Reduced:	N2O4H10C11 (1)
Stoich.:	A2B4C10D11 (1)
Weight, g/mol:	266.116761
ΔH_f, kcal/mol:	-88.42
Dipole, Da:	3.69
IP(EA), eV:	-10.6(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(E)-3-phenylprop-1-enyl]furo[2,3-d]pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CC(=O)CCOC(=O)C1=COC2=C1C=CN=N2

DOS

IR

Vibrations