Geometry & MOs

Info

ID:	388001
PubChem CID:	134987781
Reduced:	ClFN2C6H6 (1)
Stoich.:	ABC2D6E6 (1)
Weight, g/mol:	154.081392
ΔH_f, kcal/mol:	-8.39
Dipole, Da:	1.17
IP(EA), eV:	-9.45(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-dimethyl-3,4-dihydro-2H-siline-6-carbaldehyde

Drug info:

PubChemData

Smile

CC1=NC=CN1/C(=C/Cl)/F

DOS

IR

Vibrations