Geometry & MOs

Info

ID:	261588
PubChem CID:	103241522
Reduced:	BrSN2O4C10H21 (1)
Stoich.:	ABC2D4E10F21 (1)
Weight, g/mol:	284.152478
ΔH_f, kcal/mol:	-186.51
Dipole, Da:	3.5
IP(EA), eV:	-8.59(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-propan-2-yl-4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-1H-pyrimidin-6-one

Drug info:

PubChemData

Smile

CCN(CCCNCC(C(=O)OC)Br)S(=O)(=O)C

DOS

IR

Vibrations