Geometry & MOs

Info

ID:	364855
PubChem CID:	127316304
Reduced:	OS2N6C16H18 (1)
Stoich.:	AB2C6D16E18 (1)
Weight, g/mol:	340.135782
ΔH_f, kcal/mol:	66.58
Dipole, Da:	4.9
IP(EA), eV:	-9.22(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(4-ethyl-1,3-thiazol-2-yl)piperidin-1-yl]-(1H-indazol-7-yl)methanone

Drug info:

PubChemData

Smile

CCC1=CSC(=N1)C2CCCN(C2)C(=O)C3=CSC(=N3)C4=NC=NN4

DOS

IR

Vibrations