Geometry & MOs

Info

ID:	279904
PubChem CID:	103845595
Reduced:	N2O2C13H20 (1)
Stoich.:	A2B2C13D20 (1)
Weight, g/mol:	261.184112
ΔH_f, kcal/mol:	-43.11
Dipole, Da:	5.12
IP(EA), eV:	-9.52(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-2-[(pyrazolo[1,5-a]pyridin-3-ylmethylamino)methyl]butan-1-ol

Drug info:

PubChemData

Smile

CCC(CC)(CNCC1=CC=C(O1)C#N)CO

DOS

IR

Vibrations