Geometry & MOs

Info

ID:	348559
PubChem CID:	127273670
Reduced:	OSN8C13H14 (1)
Stoich.:	ABC8D13E14 (1)
Weight, g/mol:	319.200825
ΔH_f, kcal/mol:	85.88
Dipole, Da:	1.65
IP(EA), eV:	-9.64(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)C3=CSC(=N3)C4=NC=NN4

DOS

IR

Vibrations