Geometry & MOs

Info

ID:	205048
PubChem CID:	80048155
Reduced:	ON5C12H17 (1)
Stoich.:	AB5C12D17 (1)
Weight, g/mol:	220.132411
ΔH_f, kcal/mol:	11.8
Dipole, Da:	5.46
IP(EA), eV:	-9.02(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]butan-1-ol

Drug info:

PubChemData

Smile

CCCNC(=O)CNC1=NN2C(=CC=CC2=N1)C

DOS

IR

Vibrations