Geometry & MOs

Info

ID:	65992
PubChem CID:	46484889
Reduced:	OF2N3C17H17 (1)
Stoich.:	AB2C3D17E17 (1)
Weight, g/mol:	369.04767
ΔH_f, kcal/mol:	-85.21
Dipole, Da:	5.74
IP(EA), eV:	-9.07(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-3-methylphenyl)-2-(4-pyrazol-1-ylphenyl)acetamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=C(C=CC=N2)C(=O)NC3=CC(=C(C=C3)F)F

DOS

IR

Vibrations