Geometry & MOs

Info

ID:	328832
PubChem CID:	126728330
Reduced:	OSN2C9H20 (1)
Stoich.:	ABC2D9E20 (1)
Weight, g/mol:	435.194026
ΔH_f, kcal/mol:	-76.84
Dipole, Da:	5.77
IP(EA), eV:	-9.02(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[2-[[4-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclohexyl]amino]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)NCCNC(=O)CC(C)S

DOS

IR

Vibrations