Geometry & MOs

Info

ID:	12925
PubChem CID:	148428
Reduced:	SN2O2C11H16 (1)
Stoich.:	AB2C2D11E16 (1)
Weight, g/mol:	240.093249
ΔH_f, kcal/mol:	-85.43
Dipole, Da:	5.32
IP(EA), eV:	-9.21(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (4,6-dimethylpyrimidin-2-yl)sulfanylformate

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)SC(=O)OC(C)(C)C)C

DOS

IR

Vibrations