Geometry & MOs

Info

ID:	25494
PubChem CID:	625872
Reduced:	N2S2C15H18 (1)
Stoich.:	A2B2C15D18 (1)
Weight, g/mol:	349.108086
ΔH_f, kcal/mol:	51.83
Dipole, Da:	7.16
IP(EA), eV:	-7.89(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 4-(4-chlorophenyl)-1,2,6-trimethyl-4H-pyridine-3,5-dicarboxylate

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C3=CN4CCCC(=S)CC4N=C3S2

DOS

IR

Vibrations