Geometry & MOs

Info

ID:	357253
PubChem CID:	127293786
Reduced:	O2N4C19H34 (1)
Stoich.:	A2B4C19D34 (1)
Weight, g/mol:	350.177647
ΔH_f, kcal/mol:	-116.09
Dipole, Da:	2.57
IP(EA), eV:	-8.28(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[3-(4-ethylpiperazin-1-yl)pyrrolidin-1-yl]-2-oxoethyl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2CCN(C2)C(=O)CNC(=O)C3CCCCC3

DOS

IR

Vibrations