Geometry & MOs

Info

ID:	26670
PubChem CID:	794535
Reduced:	ON3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	326.141913
ΔH_f, kcal/mol:	29.12
Dipole, Da:	8.18
IP(EA), eV:	-8.3(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-3,5-diphenyl-3,4-dihydropyrazol-2-yl]-phenylmethanone

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C=NC2=CC=CC(=C2)C(=O)N

DOS

IR

Vibrations