Geometry & MOs

Info

ID:	125195
PubChem CID:	50914515
Reduced:	F2O3N4C21H22 (1)
Stoich.:	A2B3C4D21E22 (1)
Weight, g/mol:	428.161518
ΔH_f, kcal/mol:	-126.22
Dipole, Da:	5.57
IP(EA), eV:	-8.74(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(3-chloro-2-methylphenoxy)-2-oxopyridin-1-yl]-4-methyl-N-(1-methylpyrazol-3-yl)pentanamide

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NC1=NN(C=C1)C)N2C=CC(=CC2=O)OC3=C(C=C(C=C3)F)F

DOS

IR

Vibrations