Geometry & MOs

Info

ID:	145893
PubChem CID:	53608285
Reduced:	N2O3C18H24 (1)
Stoich.:	A2B3C18D24 (1)
Weight, g/mol:	304.135782
ΔH_f, kcal/mol:	-153.47
Dipole, Da:	7.74
IP(EA), eV:	-9.41(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-ethyl-1,3-thiazol-5-yl)-[2-(pyrazol-1-ylmethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1CCC(CC1)(C)NC(=O)C2=CC3=C(CCCC3=O)NC2=O

DOS

IR

Vibrations