Geometry & MOs

Info

ID:	195680
PubChem CID:	78722970
Reduced:	SN3O4C20H21 (1)
Stoich.:	AB3C4D20E21 (1)
Weight, g/mol:	420.135508
ΔH_f, kcal/mol:	-111.41
Dipole, Da:	1.22
IP(EA), eV:	-9.01(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,4-dimethoxyanilino)-2-oxoethyl] 3-methyl-2-(thiophene-2-carbonylamino)butanoate

Drug info:

PubChemData

Smile

CC1=CC=CC2=NC(=CC(=O)N12)COC(=O)C(C(C)C)NC(=O)C3=CC=CS3

DOS

IR

Vibrations