Geometry & MOs

Info

ID:	348329
PubChem CID:	127273394
Reduced:	O2N5C14H21 (1)
Stoich.:	A2B5C14D21 (1)
Weight, g/mol:	332.14193
ΔH_f, kcal/mol:	-62.99
Dipole, Da:	4.21
IP(EA), eV:	-9.53(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)C3CCN(C(=O)C3)C

DOS

IR

Vibrations