Geometry & MOs

Info

ID:	265086
PubChem CID:	103509945
Reduced:	SN2O3C15H22 (1)
Stoich.:	AB2C3D15E22 (1)
Weight, g/mol:	314.130028
ΔH_f, kcal/mol:	-108.71
Dipole, Da:	5.52
IP(EA), eV:	-7.93(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-amino-4-methoxy-5-[(2-methoxycyclopentyl)amino]thiophene-2-carboxylate

Drug info:

PubChemData

Smile

COC1CCCC1NC2=C(C(=C(S2)C(=O)OC)N)C3CC3

DOS

IR

Vibrations