Geometry & MOs

Info

ID:	132683
PubChem CID:	51401239
Reduced:	N3F4C5H7 (1)
Stoich.:	A3B4C5D7 (1)
Weight, g/mol:	214.079393
ΔH_f, kcal/mol:	-168.83
Dipole, Da:	1.41
IP(EA), eV:	-9.37(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-fluoro-4-methylphenyl)benzaldehyde

Drug info:

PubChemData

Smile

C1[C@@H](C(C1(F)F)(F)F)C(=NN)N

DOS

IR

Vibrations