Geometry & MOs

Info

ID:	351680
PubChem CID:	127280767
Reduced:	ON6C19H34 (1)
Stoich.:	AB6C19D34 (1)
Weight, g/mol:	348.26376
ΔH_f, kcal/mol:	-37.35
Dipole, Da:	3.23
IP(EA), eV:	-8.82(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-[4-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC(C)C1=NN=C(N1C)CN2CCN(CC2)CC(=O)NC3CCCCC3

DOS

IR

Vibrations