Geometry & MOs

Info

ID:	287179
PubChem CID:	104233908
Reduced:	BrFON2H12C15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	182.037922
ΔH_f, kcal/mol:	-10.32
Dipole, Da:	3.37
IP(EA), eV:	-8.93(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluoro-6-methoxyphenyl)-2-oxoacetaldehyde

Drug info:

PubChemData

Smile

CC1=CC(=CN2C1=NC(=C2)C3=C(C=CC=C3F)OC)Br

DOS

IR

Vibrations