Geometry & MOs

Info

ID:	417967
PubChem CID:	135103184
Reduced:	NO4C13H17 (1)
Stoich.:	AB4C13D17 (1)
Weight, g/mol:	379.145596
ΔH_f, kcal/mol:	-156.71
Dipole, Da:	6.05
IP(EA), eV:	-9.49(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(2,6-difluorophenyl)-1,2,4-oxadiazol-3-yl]methyl]-2-(1-ethyl-3-oxopiperazin-2-yl)acetamide

Drug info:

PubChemData

Smile

C1CN(CC1(CO)O)CC2=CC(=CC=C2)C(=O)O

DOS

IR

Vibrations