Geometry & MOs

Info

ID:	131342
PubChem CID:	51193285
Reduced:	O4N5C20H23 (1)
Stoich.:	A4B5C20D23 (1)
Weight, g/mol:	364.193297
ΔH_f, kcal/mol:	-43.12
Dipole, Da:	4.67
IP(EA), eV:	-8.72(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dimethylpropanoyl)-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCCCOC1=C(C=C(C=C1)C(=O)NNC(=O)CN2C3=CC=CC=C3N=N2)OC

DOS

IR

Vibrations