Geometry & MOs

Info

ID:	237008
PubChem CID:	92716756
Reduced:	N2S2O3C21H24 (1)
Stoich.:	A2B2C3D21E24 (1)
Weight, g/mol:	430.138485
ΔH_f, kcal/mol:	-68.99
Dipole, Da:	6.0
IP(EA), eV:	-9.03(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)N(CC2=CC=CC=C2C)C3=N[C@@H]4CS(=O)(=O)C[C@@H]4S3

DOS

IR

Vibrations