Geometry & MOs

Info

ID:	410982
PubChem CID:	135083786
Reduced:	ClOC9H13 (1)
Stoich.:	ABC9D13 (1)
Weight, g/mol:	312.03611
ΔH_f, kcal/mol:	-33.14
Dipole, Da:	2.74
IP(EA), eV:	-9.93(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-2-(bromomethyl)-3-phenylmethoxyprop-1-enyl]-1,3-dioxolane

Drug info:

PubChemData

Smile

CCC(=O)C=C=CCCCCl

DOS

IR

Vibrations