Geometry & MOs

Info

ID:	348534
PubChem CID:	127273645
Reduced:	O2N5C17H27 (1)
Stoich.:	A2B5C17D27 (1)
Weight, g/mol:	345.191323
ΔH_f, kcal/mol:	-79.74
Dipole, Da:	3.47
IP(EA), eV:	-9.51(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[2-[(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]-2-oxoethyl]-2-pyrazol-1-ylpropanamide

Drug info:

PubChemData

Smile

CCCC(=O)N1CCCC(C1)C(=O)NC2CCC3=NC(=NN3C2)C

DOS

IR

Vibrations