Geometry & MOs

Info

ID:	130633
PubChem CID:	51091832
Reduced:	F2O2N3C17H19 (1)
Stoich.:	A2B2C3D17E19 (1)
Weight, g/mol:	325.140197
ΔH_f, kcal/mol:	-129.8
Dipole, Da:	2.49
IP(EA), eV:	-8.75(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-N-methyl-N-[3-(3-phenyl-1H-pyrazol-5-yl)propyl]propanamide

Drug info:

PubChemData

Smile

C1CC(OC1)CN2C=C(C=N2)NC(=O)CCC3=C(C=CC(=C3)F)F

DOS

IR

Vibrations