Geometry & MOs

Info

ID:	151466
PubChem CID:	53812424
Reduced:	NSO4H10C14F17 (1)
Stoich.:	ABC4D10E14F17 (1)
Weight, g/mol:	300.161997
ΔH_f, kcal/mol:	-1000.13
Dipole, Da:	2.79
IP(EA), eV:	-10.48(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5,7-diethyl-4,6-dihydro-[1,2]thiazolo[3,4-d]pyrimidin-3-yl)-(2-hydroxyethyl)amino]ethanol

Drug info:

PubChemData

Smile

CCS(=O)(=O)N(C=C(C)C(=O)O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

DOS

IR

Vibrations