Geometry & MOs

Info

ID:	343531
PubChem CID:	127266704
Reduced:	SN3O4C16H19 (1)
Stoich.:	AB3C4D16E19 (1)
Weight, g/mol:	322.146347
ΔH_f, kcal/mol:	-99.74
Dipole, Da:	8.8
IP(EA), eV:	-8.03(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(methoxymethyl)-6-methylpyrimidin-4-yl]amino]-2-(2-propan-2-yl-1,3-thiazol-4-yl)ethanol

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN=C(N=C1C)OC2=CC=C(C=C2)N=S(=O)(C)C

DOS

IR

Vibrations