Geometry & MOs

Info

ID:	344474
PubChem CID:	127267650
Reduced:	O2N4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	389.188546
ΔH_f, kcal/mol:	9.85
Dipole, Da:	3.85
IP(EA), eV:	-9.05(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]amino]-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2(CC2)C(=O)N3CCN(CC3)CC4=NC(=NO4)C

DOS

IR

Vibrations