Geometry & MOs

Info

ID:	318388
PubChem CID:	126651052
Reduced:	NC8H14 (2)
Stoich.:	AB8C14 (2)
Weight, g/mol:	574.151822
ΔH_f, kcal/mol:	-17.86
Dipole, Da:	0.62
IP(EA), eV:	-9.29(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-[4-[5-chloro-2-(2-fluoroethoxy)phenyl]-5-methoxy-2-oxopyridin-1-yl]-3-(1,4-dioxan-2-yl)propanoyl]amino]benzoic acid

Drug info:

PubChemData

Smile

CCCCCC(CC)C1=C(C=CC=C1CN)CN

DOS

IR

Vibrations