Geometry & MOs

Info

ID:	42034
PubChem CID:	8148204
Reduced:	SO2N4C17H24 (1)
Stoich.:	AB2C4D17E24 (1)
Weight, g/mol:	346.171499
ΔH_f, kcal/mol:	-83.76
Dipole, Da:	2.3
IP(EA), eV:	-8.71(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dimethoxyphenyl)-4-[[(3R,5R)-3,5-dimethylpiperidin-1-yl]methyl]-1,3-thiazole

Drug info:

PubChemData

Smile

C[C@H]1CCC2=C(C1)SC3=C2C(=O)NC(=N3)[C@@H](C)NCCNC(=O)C

DOS

IR

Vibrations