Geometry & MOs

Info

ID:	217611
PubChem CID:	85088102
Reduced:	NSiO2C23H31 (1)
Stoich.:	ABC2D23E31 (1)
Weight, g/mol:	385.115296
ΔH_f, kcal/mol:	-101.06
Dipole, Da:	4.39
IP(EA), eV:	-8.88(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-pyridin-1-ium-1-yl-3,4,5,6-tetrahydro-1H-purin-2-one;chloride

Drug info:

PubChemData

Smile

CC=CC(CO[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C(C)(C)C)NC(=O)C

DOS

IR

Vibrations