Geometry & MOs

Info

ID:	65974
PubChem CID:	46484792
Reduced:	F3N3O4H20C21 (1)
Stoich.:	A3B3C4D20E21 (1)
Weight, g/mol:	387.155847
ΔH_f, kcal/mol:	-282.93
Dipole, Da:	4.02
IP(EA), eV:	-8.54(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-[3,5-dimethyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)NC(=O)CN2C(=O)C(NC2=O)(C)C3=CC(=CC=C3)C(F)(F)F

DOS

IR

Vibrations