Geometry & MOs

Info

ID:	359622
PubChem CID:	127298896
Reduced:	O3N4C15H24 (1)
Stoich.:	A3B4C15D24 (1)
Weight, g/mol:	371.19574
ΔH_f, kcal/mol:	-145.14
Dipole, Da:	6.64
IP(EA), eV:	-8.86(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,5-dimethyl-N-(1-methylpiperidin-4-yl)triazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C(=O)C2CCC3(CC2)C(=O)NC(=O)N3

DOS

IR

Vibrations