Geometry & MOs

Info

ID:	377920
PubChem CID:	134223986
Reduced:	SN2O2F3C19H23 (1)
Stoich.:	AB2C2D3E19F23 (1)
Weight, g/mol:	485.189291
ΔH_f, kcal/mol:	-223.67
Dipole, Da:	6.14
IP(EA), eV:	-8.79(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[3-[[5-chloro-3-(difluoromethyl)-1-methylpyrazole-4-carbonyl]amino]-2-methylphenoxy]octanoate

Drug info:

PubChemData

Smile

CCCCC(C)OC1=CC=CC(=C1C)NC(=O)C2=C(N=C(S2)C)C(F)(F)F

DOS

IR

Vibrations