Geometry & MOs

Info

ID:	153527
PubChem CID:	56312766
Reduced:	FO2N3C23H24 (1)
Stoich.:	AB2C3D23E24 (1)
Weight, g/mol:	373.252941
ΔH_f, kcal/mol:	-55.52
Dipole, Da:	4.73
IP(EA), eV:	-9.37(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[2-(2-fluorophenyl)-2-methylpropyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)NCC(C)(C)C3=CC=CC=C3F

DOS

IR

Vibrations