Geometry & MOs

Info

ID:	28262
PubChem CID:	826615
Reduced:	NOSC15H17 (1)
Stoich.:	ABCD15E17 (1)
Weight, g/mol:	249.116507
ΔH_f, kcal/mol:	3.23
Dipole, Da:	2.35
IP(EA), eV:	-8.54(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(4-fluorophenyl)-1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate

Drug info:

PubChemData

Smile

CN(C)CC1=CC(=CC=C1)SC2=CC=CC(=C2)O

DOS

IR

Vibrations