Geometry & MOs

Info

ID:	196375
PubChem CID:	78816890
Reduced:	F2N3O3C14H15 (1)
Stoich.:	A2B3C3D14E15 (1)
Weight, g/mol:	273.147727
ΔH_f, kcal/mol:	-132.57
Dipole, Da:	2.21
IP(EA), eV:	-9.28(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-(2-hydroxyethyl)acetamide

Drug info:

PubChemData

Smile

C1COCCN1CC2=NC(=NO2)C3=CC=CC=C3OC(F)F

DOS

IR

Vibrations