Geometry & MOs

Info

ID:	363472
PubChem CID:	127311275
Reduced:	ON2C11H17 (2)
Stoich.:	AB2C11D17 (2)
Weight, g/mol:	358.092204
ΔH_f, kcal/mol:	-98.81
Dipole, Da:	5.23
IP(EA), eV:	-9.14(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-thiophen-3-yl-1,3-thiazol-5-yl)methanone

Drug info:

PubChemData

Smile

CCC1=NC=CN1C2CCCN(C2)C(=O)C3CCCCC3C(=O)N4CCCC4

DOS

IR

Vibrations