Geometry & MOs

Info

ID:	197556
PubChem CID:	78977784
Reduced:	NSO4C11H21 (1)
Stoich.:	ABC4D11E21 (1)
Weight, g/mol:	309.139865
ΔH_f, kcal/mol:	-180.1
Dipole, Da:	4.4
IP(EA), eV:	-9.82(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(5-methyl-4-propylthiophene-2-carbonyl)-prop-2-enylamino]acetate

Drug info:

PubChemData

Smile

CCCCS(=O)(=O)N(CC=C)CC(=O)OCC

DOS

IR

Vibrations