Geometry & MOs

Info

ID:	367039
PubChem CID:	127322971
Reduced:	O2N3C15H25 (1)
Stoich.:	A2B3C15D25 (1)
Weight, g/mol:	263.17461
ΔH_f, kcal/mol:	-101.46
Dipole, Da:	2.99
IP(EA), eV:	-8.8(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-azabicyclo[2.2.2]octan-3-yl)-N-methyl-2-(1,2,4-triazol-1-yl)propanamide

Drug info:

PubChemData

Smile

CC(=O)N1CCCC1C(=O)N(C)C2CN3CCC2CC3

DOS

IR

Vibrations