Geometry & MOs

Info

ID:	405814
PubChem CID:	135075572
Reduced:	O3C14H18 (1)
Stoich.:	A3B14C18 (1)
Weight, g/mol:	328.951769
ΔH_f, kcal/mol:	-117.6
Dipole, Da:	5.17
IP(EA), eV:	-9.52(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-1-dichlorophosphoryl-3,4-dimethyl-6-(trifluoromethyl)-2,5-dihydropyridine

Drug info:

PubChemData

Smile

C[C@@H]1CCC=C([C@@]12CC(=C(C2=O)O)C(=O)C)C

DOS

IR

Vibrations