Geometry & MOs

Info

ID:	25620
PubChem CID:	627484
Reduced:	NO4C17H21 (1)
Stoich.:	AB4C17D21 (1)
Weight, g/mol:	303.137162
ΔH_f, kcal/mol:	-143.02
Dipole, Da:	4.7
IP(EA), eV:	-8.66(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(furan-2-yl)-2-phenyl-3,4-dihydropyrazol-5-yl]-2-methylpyridine

Drug info:

PubChemData

Smile

CN1CCC23C4C(CCC2(C1CC5=C3C(=C(C=C5)O)O4)O)O

DOS

IR

Vibrations