Geometry & MOs

Info

ID:	381106
PubChem CID:	134971750
Reduced:	ON2C19H22 (1)
Stoich.:	AB2C19D22 (1)
Weight, g/mol:	292.157563
ΔH_f, kcal/mol:	25.71
Dipole, Da:	2.04
IP(EA), eV:	-9.47(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4R,5R)-3-ethenyl-5-ethyl-3,5-diphenyl-4H-pyrazol-4-ol

Drug info:

PubChemData

Smile

CC[C@]1(C([C@@](N=N1)(CC)C2=CC=CC=C2)O)C3=CC=CC=C3

DOS

IR

Vibrations