Geometry & MOs

Info

ID:	158211
PubChem CID:	56463168
Reduced:	ClSF3N3O4C18H21 (1)
Stoich.:	ABC3D3E4F18G21 (1)
Weight, g/mol:	340.160935
ΔH_f, kcal/mol:	-320.61
Dipole, Da:	4.95
IP(EA), eV:	-9.29(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

DOS

IR

Vibrations