Geometry & MOs

Info

ID:	276814
PubChem CID:	103825383
Reduced:	NO4C16H23 (1)
Stoich.:	AB4C16D23 (1)
Weight, g/mol:	297.151098
ΔH_f, kcal/mol:	-166.11
Dipole, Da:	2.7
IP(EA), eV:	-8.76(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-2,2-dimethylbutyl)-2,4-dimethyl-6-methylsulfanylpyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CCO)CNC(=O)CCC1=CC2=C(C=C1)OCO2

DOS

IR

Vibrations