Geometry & MOs

Info

ID:	405156
PubChem CID:	135072793
Reduced:	ClSeN2O5C9H11 (1)
Stoich.:	ABC2D5E9F11 (1)
Weight, g/mol:	274.19328
ΔH_f, kcal/mol:	-208.7
Dipole, Da:	3.74
IP(EA), eV:	-9.67(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1S,2S,3R)-2-(methoxymethyl)-1-methyl-3-prop-2-enylcyclopropyl]ethoxymethylbenzene

Drug info:

PubChemData

Smile

C1=C(C(=O)NC(=O)N1[C@H]2C(C([C@H]([Se]2)CO)O)O)Cl

DOS

IR

Vibrations