Geometry & MOs

Info

ID:	207691
PubChem CID:	80439113
Reduced:	ISN3C15H26 (1)
Stoich.:	ABC3D15E26 (1)
Weight, g/mol:	358.99532
ΔH_f, kcal/mol:	-1.35
Dipole, Da:	4.47
IP(EA), eV:	-8.52(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-iodo-6-(2-methylpropyl)-2-thiophen-3-ylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCNC1=NC(=NC(=C1I)CC(C)C)CSCC(C)C

DOS

IR

Vibrations