Geometry & MOs

Info

ID:	55384
PubChem CID:	17395317
Reduced:	ON3C19H23 (1)
Stoich.:	AB3C19D23 (1)
Weight, g/mol:	345.151098
ΔH_f, kcal/mol:	2.68
Dipole, Da:	2.62
IP(EA), eV:	-8.51(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-phenylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=CC=C2)C(=O)NCCC3=CC=CC=C3

DOS

IR

Vibrations