Geometry & MOs

Info

ID:	356609
PubChem CID:	127291835
Reduced:	O2N3C18H23 (1)
Stoich.:	A2B3C18D23 (1)
Weight, g/mol:	377.177313
ΔH_f, kcal/mol:	-51.77
Dipole, Da:	5.05
IP(EA), eV:	-8.7(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-benzoyl-1,3-thiazolidin-4-yl)-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)(CN1CCN(CC1)C(=O)C2=CN=CC3=CC=CC=C32)O

DOS

IR

Vibrations