Geometry & MOs

Info

ID:	361153
PubChem CID:	127302097
Reduced:	O2S2N3C19H25 (1)
Stoich.:	A2B2C3D19E25 (1)
Weight, g/mol:	389.188546
ΔH_f, kcal/mol:	-34.28
Dipole, Da:	2.4
IP(EA), eV:	-8.57(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylpyrazol-4-yl)-N-[(4-piperidin-1-yloxan-4-yl)methyl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2(CCOCC2)CNC(=O)C3=CSC(=N3)C4=CC=CS4

DOS

IR

Vibrations