Geometry & MOs

Info

ID:	265505
PubChem CID:	103526391
Reduced:	SO2N4C14H18 (1)
Stoich.:	AB2C4D14E18 (1)
Weight, g/mol:	291.104148
ΔH_f, kcal/mol:	-35.51
Dipole, Da:	5.39
IP(EA), eV:	-8.24(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-amino-5-[(3-methylpyridin-2-yl)methylamino]thiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(N=CC=C1)CNC2=C(C(=C(S2)C(=O)NC)N)OC

DOS

IR

Vibrations