Geometry & MOs

Info

ID:	367549
PubChem CID:	127324917
Reduced:	ON6C14H24 (1)
Stoich.:	AB6C14D24 (1)
Weight, g/mol:	362.243024
ΔH_f, kcal/mol:	19.45
Dipole, Da:	5.74
IP(EA), eV:	-8.83(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-2-[4-[4-(4-methylcyclohexyl)piperazine-1-carbonyl]triazol-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)N2CCN(CC2)C(=O)CN3C=NN=N3

DOS

IR

Vibrations