Geometry & MOs

Info

ID:	244633
PubChem CID:	99368602
Reduced:	N2O3C25H32 (1)
Stoich.:	A2B3C25D32 (1)
Weight, g/mol:	430.186104
ΔH_f, kcal/mol:	-95.63
Dipole, Da:	1.89
IP(EA), eV:	-8.64(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-4-(thiomorpholin-4-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CCC(=O)C1=CC=C(C=C1)OCC(=O)NCC2=CC(=CC=C2)CN3CCC(CC3)C

DOS

IR

Vibrations