Geometry & MOs

Info

ID:	310748
PubChem CID:	126587146
Reduced:	ClNC8H10 (1)
Stoich.:	ABC8D10 (1)
Weight, g/mol:	384.168522
ΔH_f, kcal/mol:	28.57
Dipole, Da:	2.78
IP(EA), eV:	-9.31(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-1-[(1S,3R)-7-methyl-1-(phenylmethoxymethyl)spiro[2,5-dioxabicyclo[2.2.1]heptane-6,1'-cyclopropane]-3-yl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C1C=CC=CC1C(=N)CCl

DOS

IR

Vibrations