Geometry & MOs

Info

ID:	298584
PubChem CID:	117651435
Reduced:	ClN2O4C16H17 (1)
Stoich.:	AB2C4D16E17 (1)
Weight, g/mol:	323.072449
ΔH_f, kcal/mol:	-124.32
Dipole, Da:	5.18
IP(EA), eV:	-9.23(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-chloro-6-propan-2-yloxypyridin-3-yl)oxy-2-fluoro-5-methylbenzaldehyde

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=C(C=N1)OC2=CC(=C(C=C2)C(=O)N)OC)Cl

DOS

IR

Vibrations