Geometry & MOs

Info

ID:	323608
PubChem CID:	126675572
Reduced:	F2N3O5C28H29 (1)
Stoich.:	A2B3C5D28E29 (1)
Weight, g/mol:	351.231063
ΔH_f, kcal/mol:	-222.31
Dipole, Da:	3.75
IP(EA), eV:	-9.34(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-[4-(cyclopentyloxymethyl)phenyl]pyridin-2-yl]-4-methylpiperazine

Drug info:

PubChemData

Smile

C1CC1(C#N)NC(C2(CCC(CC2)(F)F)NC(=O)C3=CC4=C(O3)C=C(C=C4)C5=CC=C(C=C5)C(CO)O)O

DOS

IR

Vibrations