Geometry & MOs

Info

ID:	435642
PubChem CID:	135192038
Reduced:	F2O2N5C21H21 (1)
Stoich.:	A2B2C5D21E21 (1)
Weight, g/mol:	578.279215
ΔH_f, kcal/mol:	-96.44
Dipole, Da:	5.71
IP(EA), eV:	-9.23(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-[4-[5-[(5-fluoro-2-methylphenoxy)methyl]-2,2,4-trimethyl-3-oxo-1H-quinoxalin-6-yl]-3-methoxyphenyl]-3-hydroxypentanoate

Drug info:

PubChemData

Smile

C[C@H](CCC1=C(C=C(C=C1)F)NC=O)NC(=O)C2=NNC(=N2)CC3=CC(=CC=C3)F

DOS

IR

Vibrations