Geometry & MOs

Info

ID:	364816
PubChem CID:	127316224
Reduced:	O2N5C15H23 (1)
Stoich.:	A2B5C15D23 (1)
Weight, g/mol:	385.157246
ΔH_f, kcal/mol:	-61.23
Dipole, Da:	6.65
IP(EA), eV:	-9.15(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-benzoyl-1,3-thiazolidin-4-yl)-[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CN1CCC(CC1=O)C(=O)N2CCN(CC2)CC3=NC=CN3

DOS

IR

Vibrations