Geometry & MOs

Info

ID:	357625
PubChem CID:	127294298
Reduced:	ON2C10H18 (2)
Stoich.:	AB2C10D18 (2)
Weight, g/mol:	292.201159
ΔH_f, kcal/mol:	-122.63
Dipole, Da:	1.56
IP(EA), eV:	-8.54(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]-(2H-triazol-4-yl)methanone

Drug info:

PubChemData

Smile

CC(C(=O)N1CCN(CC1)CC2CCCCN2C)NC(=O)C3CCCC3

DOS

IR

Vibrations