Geometry & MOs

Info

ID:	154138
PubChem CID:	56313534
Reduced:	FN2O2C21H25 (1)
Stoich.:	AB2C2D21E25 (1)
Weight, g/mol:	379.205991
ΔH_f, kcal/mol:	-115.55
Dipole, Da:	3.43
IP(EA), eV:	-9.63(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)NCCC(=O)NCC(C)(C)C2=CC=CC=C2F

DOS

IR

Vibrations