Geometry & MOs

Info

ID:	30465
PubChem CID:	841370
Reduced:	FOCl2N3H10C12 (1)
Stoich.:	ABC2D3E10F12 (1)
Weight, g/mol:	334.12772
ΔH_f, kcal/mol:	-44.26
Dipole, Da:	9.96
IP(EA), eV:	-8.93(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethoxyphenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C(=O)NC2=CC(=C(C=C2)F)Cl)Cl

DOS

IR

Vibrations