Geometry & MOs

Info

ID:	264990
PubChem CID:	103506288
Reduced:	SN2O2C14H22 (1)
Stoich.:	AB2C2D14E22 (1)
Weight, g/mol:	318.107185
ΔH_f, kcal/mol:	-100.62
Dipole, Da:	6.69
IP(EA), eV:	-8.03(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-amino-4-methylsulfanyl-5-(2-propan-2-yloxyethylamino)thiophene-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C=C(S1)N2CCC(C2)C(C)C)N

DOS

IR

Vibrations