Geometry & MOs

Info

ID:	156983
PubChem CID:	56404338
Reduced:	N2O4C17H28 (1)
Stoich.:	A2B4C17D28 (1)
Weight, g/mol:	418.156243
ΔH_f, kcal/mol:	-202.65
Dipole, Da:	5.91
IP(EA), eV:	-9.33(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazol-5-yl]-[4-(1,3-dioxolan-2-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CCC(=O)N1CCCC(C1)C(=O)N2CCC(CC2)C3OCCO3

DOS

IR

Vibrations