Geometry & MOs

Info

ID:	280111
PubChem CID:	103846938
Reduced:	ClFNO3H9C10 (1)
Stoich.:	ABCD3E9F10 (1)
Weight, g/mol:	166.018542
ΔH_f, kcal/mol:	-173.92
Dipole, Da:	6.06
IP(EA), eV:	-9.9(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-ethenylbenzaldehyde

Drug info:

PubChemData

Smile

C1=C(C=C(C=C1F)Cl)NC(=O)CCC(=O)O

DOS

IR

Vibrations