Geometry & MOs

Info

ID:	348366
PubChem CID:	127273431
Reduced:	O3N4C15H24 (1)
Stoich.:	A3B4C15D24 (1)
Weight, g/mol:	393.04848
ΔH_f, kcal/mol:	-108.5
Dipole, Da:	1.59
IP(EA), eV:	-9.61(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)C(C)OCC3CCCO3

DOS

IR

Vibrations