Geometry & MOs

Info

ID:	267678
PubChem CID:	103584279
Reduced:	BrClN2O2H10C11 (1)
Stoich.:	ABC2D2E10F11 (1)
Weight, g/mol:	294.129217
ΔH_f, kcal/mol:	-33.71
Dipole, Da:	2.46
IP(EA), eV:	-10.11(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-(2,5-difluoro-4-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C(C)(C#N)C1=C(C=C(C=N1)Br)Cl

DOS

IR

Vibrations