Geometry & MOs

Info

ID:	265031
PubChem CID:	103507295
Reduced:	SO2N5C13H21 (1)
Stoich.:	AB2C5D13E21 (1)
Weight, g/mol:	296.167083
ΔH_f, kcal/mol:	-84.02
Dipole, Da:	8.49
IP(EA), eV:	-8.31(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-ethyl-5-(3,4,5-trimethylpiperazin-1-yl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CC(N1C)C)C2=C(C(=C(S2)C(=O)N)N)C(=O)N

DOS

IR

Vibrations