Geometry & MOs

Info

ID:	351257
PubChem CID:	127280145
Reduced:	O2N6C21H30 (1)
Stoich.:	A2B6C21D30 (1)
Weight, g/mol:	384.227374
ΔH_f, kcal/mol:	-30.43
Dipole, Da:	7.58
IP(EA), eV:	-9.19(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-methyl-2-[4-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NN=C2N1C=C(C=C2)C(=O)N3CCN(CC3)CC(=O)N(C)C4CCCCC4

DOS

IR

Vibrations