Geometry & MOs

Info

ID:	449034
PubChem CID:	135295412
Reduced:	SN5C15H19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	441.01203
ΔH_f, kcal/mol:	94.86
Dipole, Da:	4.01
IP(EA), eV:	-8.3(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(2,4-dimethylimidazol-1-yl)-7-iodothieno[3,2-d]pyrimidin-2-yl]morpholine

Drug info:

PubChemData

Smile

C=CC1=CSC(=N1)NC2=NC=CC(=CC2)N3CCNCC3

DOS

IR

Vibrations