Geometry & MOs

Info

ID:	345219
PubChem CID:	127268979
Reduced:	O3N7C18H23 (1)
Stoich.:	A3B7C18D23 (1)
Weight, g/mol:	319.175673
ΔH_f, kcal/mol:	-34.11
Dipole, Da:	3.31
IP(EA), eV:	-8.64(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethylpyrazol-4-yl)-4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN2CCN(CC2)C(=O)NC3=CC(=CC=C3)N4CCNC4=O

DOS

IR

Vibrations