Geometry & MOs

Info

ID:	30367
PubChem CID:	841201
Reduced:	FNOH7C8 (2)
Stoich.:	ABCD7E8 (2)
Weight, g/mol:	307.113233
ΔH_f, kcal/mol:	-112.01
Dipole, Da:	2.65
IP(EA), eV:	-9.12(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetylphenyl)-2-[3-(difluoromethyl)-5-methylpyrazol-1-yl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(=O)NN=CC2=CC=C(C=C2)OC(F)F

DOS

IR

Vibrations