Geometry & MOs

Info

ID:	350268
PubChem CID:	127277346
Reduced:	N2O2C13H24 (1)
Stoich.:	A2B2C13D24 (1)
Weight, g/mol:	304.189926
ΔH_f, kcal/mol:	-102.53
Dipole, Da:	3.15
IP(EA), eV:	-8.8(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)piperidin-1-yl]-(oxan-3-yl)methanone

Drug info:

PubChemData

Smile

CN(C)C1CCN(CC1)C(=O)C2CCCOC2

DOS

IR

Vibrations