Geometry & MOs

Info

ID:	199064
PubChem CID:	79193510
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	299.119129
ΔH_f, kcal/mol:	-110.11
Dipole, Da:	5.27
IP(EA), eV:	-8.64(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(4-hydroxypentanoylamino)-4,5-dimethylthiophene-3-carboxylate

Drug info:

PubChemData

Smile

CCCCCC1=CC=C(C=C1)NC(=O)CCCCO

DOS

IR

Vibrations