Geometry & MOs

Info

ID:	342461
PubChem CID:	127265616
Reduced:	N2O3H12C13 (1)
Stoich.:	A2B3C12D13 (1)
Weight, g/mol:	224.094963
ΔH_f, kcal/mol:	-37.47
Dipole, Da:	1.9
IP(EA), eV:	-9.47(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethenyl]pyrimidine

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(O1)C=CC2=NC=NC=C2

DOS

IR

Vibrations