Geometry & MOs

Info

ID:	367458
PubChem CID:	127324698
Reduced:	ON5C15H25 (1)
Stoich.:	AB5C15D25 (1)
Weight, g/mol:	389.161853
ΔH_f, kcal/mol:	-38.09
Dipole, Da:	3.98
IP(EA), eV:	-9.44(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chlorophenyl)-N-(2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)N3CCCC3(C)C

DOS

IR

Vibrations