Geometry & MOs

Info

ID:	154470
PubChem CID:	56313913
Reduced:	FNO3C22H26 (1)
Stoich.:	ABC3D22E26 (1)
Weight, g/mol:	382.180504
ΔH_f, kcal/mol:	-158.36
Dipole, Da:	6.35
IP(EA), eV:	-9.4(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-N-[2-(2-fluorophenyl)-2-methylpropyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide

Drug info:

PubChemData

Smile

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NCC(C)(C)C3=CC=CC=C3F

DOS

IR

Vibrations