Geometry & MOs

Info

ID:	346173
PubChem CID:	127270661
Reduced:	O2N5C19H35 (1)
Stoich.:	A2B5C19D35 (1)
Weight, g/mol:	356.23246
ΔH_f, kcal/mol:	-80.64
Dipole, Da:	6.67
IP(EA), eV:	-8.72(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[cyclopropyl(ethyl)amino]ethyl]-4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCN(CCNC(=O)N1CCC(CC1)C(=O)N2CCN(CC2)C)C3CC3

DOS

IR

Vibrations