Geometry & MOs

Info

ID:	373567
PubChem CID:	131317350
Reduced:	ClNOC13H14 (1)
Stoich.:	ABCD13E14 (1)
Weight, g/mol:	241.951305
ΔH_f, kcal/mol:	-24.58
Dipole, Da:	1.24
IP(EA), eV:	-9.27(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dichloro-2-(trifluoromethyl)benzaldehyde

Drug info:

PubChemData

Smile

C[C@](CO)(C1=CC2=C(C=C1)C=CC(=C2)Cl)N

DOS

IR

Vibrations