Geometry & MOs

Info

ID:	323619
PubChem CID:	126675597
Reduced:	O2N10C23H30 (1)
Stoich.:	A2B10C23D30 (1)
Weight, g/mol:	378.267114
ΔH_f, kcal/mol:	64.35
Dipole, Da:	5.32
IP(EA), eV:	-8.13(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[4-[4-(cyclopentyloxymethyl)phenyl]phenyl]methyl]-3,5-dimethylpiperazine

Drug info:

PubChemData

Smile

CC1=NN=C(O1)C2C[C@H](CN2)OC3=CC=CC(=C3)CN=C/C(=C\N)/CC4=CC(=NC(=C4N)NN)N

DOS

IR

Vibrations