Geometry & MOs

Info

ID:	357493
PubChem CID:	127294126
Reduced:	O2N6C17H20 (1)
Stoich.:	A2B6C17D20 (1)
Weight, g/mol:	394.096331
ΔH_f, kcal/mol:	45.48
Dipole, Da:	2.47
IP(EA), eV:	-8.75(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,4-dichlorophenyl)cyclopropyl]-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN2CCN(CC2)C(=O)CN3C4=CC=CC=C4C=N3

DOS

IR

Vibrations