Geometry & MOs

Info

ID:	48259
PubChem CID:	10538402
Reduced:	OC8H11 (2)
Stoich.:	AB8C11 (2)
Weight, g/mol:	245.89445
ΔH_f, kcal/mol:	-99.56
Dipole, Da:	3.31
IP(EA), eV:	-8.61(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-3-iodoprop-2-enyl] carbonochloridate

Drug info:

PubChemData

Smile

CC1(CC[C@@H]2[C@@H](O1)C3=CC=CC=C3OC2(C)C)C

DOS

IR

Vibrations