Geometry & MOs

Info

ID:	328864
PubChem CID:	126728408
Reduced:	N2O2C15H26 (1)
Stoich.:	A2B2C15D26 (1)
Weight, g/mol:	335.141596
ΔH_f, kcal/mol:	-89.83
Dipole, Da:	4.43
IP(EA), eV:	-9.02(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[2-[[4-(aminomethyl)cyclohexyl]amino]pyrimidin-4-yl]methylidene]-4-hydroxy-1,3-thiazolidin-2-one

Drug info:

PubChemData

Smile

CC(C)NCCNC(=O)COC1=CC/C=C/CCC1

DOS

IR

Vibrations