Geometry & MOs

Info

ID:	185628
PubChem CID:	77322223
Reduced:	Si2O3C20H36 (1)
Stoich.:	A2B3C20D36 (1)
Weight, g/mol:	466.149992
ΔH_f, kcal/mol:	-153.35
Dipole, Da:	1.96
IP(EA), eV:	-7.51(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[7a-(2-fluoro-5-nitrophenyl)-3,5-dimethyl-4-oxo-5,7-dihydro-4aH-furo[3,4-d]pyrimidin-2-yl]-[(2-methylpropan-2-yl)oxycarbonyl]carbamic acid

Drug info:

PubChemData

Smile

CC(CO)C1=CCCC2C1(CCCC2C(C)(C)C(O[Si]C)O[Si]C)C

DOS

IR

Vibrations