Geometry & MOs

Info

ID:	189880
PubChem CID:	77919182
Reduced:	FSN3O3C16H20 (1)
Stoich.:	ABC3D3E16F20 (1)
Weight, g/mol:	375.143905
ΔH_f, kcal/mol:	-128.04
Dipole, Da:	3.27
IP(EA), eV:	-9.18(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(4-methyl-1,3-thiazol-5-yl)methyl]-1-(2-thiophen-2-ylethyl)-4,4a,5,7,8,8a-hexahydro-3H-1,6-naphthyridin-2-one

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=CN=C(O2)C)S(=O)(=O)NCC3CC(CN3)F

DOS

IR

Vibrations