Geometry & MOs

Info

ID:	237007
PubChem CID:	92716755
Reduced:	N2S2O3C14H18 (1)
Stoich.:	A2B2C3D14E18 (1)
Weight, g/mol:	416.122835
ΔH_f, kcal/mol:	-84.26
Dipole, Da:	6.64
IP(EA), eV:	-9.04(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,6aR)-N-(4-ethoxyphenyl)-N-[(2-methylphenyl)methyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-amine

Drug info:

PubChemData

Smile

CCN(C1=CC(=CC=C1)OC)C2=N[C@H]3CS(=O)(=O)C[C@H]3S2

DOS

IR

Vibrations