Geometry & MOs

Info

ID:	214784
PubChem CID:	85083635
Reduced:	NSiO5C37H41 (1)
Stoich.:	ABC5D37E41 (1)
Weight, g/mol:	610.13285
ΔH_f, kcal/mol:	-95.95
Dipole, Da:	2.13
IP(EA), eV:	-8.17(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2,2-bis[(4-methylphenoxy)methyl]cyclopropyl]-5-iodo-3-(4-methylphenyl)-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC1(C(OC(O1)C2=CC=CC=C2)C3C=C(ON3C)[Si](C)(C)C)C4=C(C=CC(=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6

DOS

IR

Vibrations