Geometry & MOs

Info

ID:	46625
PubChem CID:	10525716
Reduced:	IN2O2Si2C12H25 (1)
Stoich.:	AB2C2D2E12F25 (1)
Weight, g/mol:	412.109293
ΔH_f, kcal/mol:	-168.25
Dipole, Da:	5.53
IP(EA), eV:	-8.15(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R,4aR,7S,8aS)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl]-5-thiophen-2-ylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=NC(=[N+]1C)O[Si](C)(C)C)O[Si](C)(C)C.[I-]

DOS

IR

Vibrations