Geometry & MOs

Info

ID:	355391
PubChem CID:	127288454
Reduced:	O2N5C16H29 (1)
Stoich.:	A2B5C16D29 (1)
Weight, g/mol:	337.247775
ΔH_f, kcal/mol:	-33.74
Dipole, Da:	0.83
IP(EA), eV:	-8.67(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]methyl]-4-propan-2-ylmorpholine

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN2CCN(CC2)CC3CN(CCO3)C(C)C

DOS

IR

Vibrations