Geometry & MOs

Info

ID:	344643
PubChem CID:	127268228
Reduced:	ON7C16H23 (1)
Stoich.:	AB7C16D23 (1)
Weight, g/mol:	331.237211
ΔH_f, kcal/mol:	41.86
Dipole, Da:	3.06
IP(EA), eV:	-8.73(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-ethyl-2-(4-pyridazin-3-ylpiperazin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)NC(=O)CN2CCN(CC2)C3=NN=CC=C3

DOS

IR

Vibrations