Geometry & MOs

Info

ID:	129076
PubChem CID:	51069199
Reduced:	FN3O3C26H26 (1)
Stoich.:	AB3C3D26E26 (1)
Weight, g/mol:	475.146283
ΔH_f, kcal/mol:	-51.94
Dipole, Da:	2.52
IP(EA), eV:	-9.17(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-cyclopropyl-N-[[5-(4-fluorophenoxy)-1-methyl-3-phenylpyrazol-4-yl]methyl]benzamide

Drug info:

PubChemData

Smile

CC(C)C(=O)N(CC1=CC=CO1)CC2=C(N(N=C2C3=CC=CC=C3)C)OC4=CC=C(C=C4)F

DOS

IR

Vibrations