Geometry & MOs

Info

ID:	132100
PubChem CID:	51305753
Reduced:	N3O4C19H23 (1)
Stoich.:	A3B4C19D23 (1)
Weight, g/mol:	361.146013
ΔH_f, kcal/mol:	-95.81
Dipole, Da:	3.1
IP(EA), eV:	-8.75(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[4-(furan-2-ylmethyl)piperazin-1-yl]-4-oxobutyl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C2=CC=CO2)C(=O)N3CCN(CC3)CC4=CC=CO4

DOS

IR

Vibrations