Geometry & MOs

Info

ID:	35727
PubChem CID:	7980249
Reduced:	NO5C18H19 (1)
Stoich.:	AB5C18D19 (1)
Weight, g/mol:	405.124609
ΔH_f, kcal/mol:	-152.18
Dipole, Da:	3.84
IP(EA), eV:	-8.94(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[2-(2-phenoxyacetyl)oxyacetyl]amino]-5-propan-2-ylthiophene-3-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CNC(=O)COC(=O)COC2=CC=CC=C2

DOS

IR

Vibrations