Geometry & MOs

Info

ID:	176140
PubChem CID:	76000436
Reduced:	N2O3C11H18 (1)
Stoich.:	A2B3C11D18 (1)
Weight, g/mol:	336.127406
ΔH_f, kcal/mol:	-161.72
Dipole, Da:	4.74
IP(EA), eV:	-10.31(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-fluorophenyl)-6-(2-phenylethyl)-6,7-dihydro-2H-pyrano[4,3-c]pyrazol-3-one

Drug info:

PubChemData

Smile

CC1C2C(CC(O1)C(C)C)NC(=O)NC2=O

DOS

IR

Vibrations