Geometry & MOs

Info

ID:	153618
PubChem CID:	56312887
Reduced:	FO2N4C23H29 (1)
Stoich.:	AB2C4D23E29 (1)
Weight, g/mol:	365.190341
ΔH_f, kcal/mol:	-78.64
Dipole, Da:	1.71
IP(EA), eV:	-8.41(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-2-methylpropyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NC2=C1C(=NN2C)OC)C)CCC(=O)NCC(C)(C)C3=CC=CC=C3F

DOS

IR

Vibrations