Geometry & MOs

Info

ID:	220711
PubChem CID:	85230650
Reduced:	OC7H7 (2)
Stoich.:	AB7C7 (2)
Weight, g/mol:	214.156895
ΔH_f, kcal/mol:	-29.51
Dipole, Da:	5.39
IP(EA), eV:	-9.2(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-butyl-1,3-dioxolan-2-yl)pent-2-en-1-ol

Drug info:

PubChemData

Smile

CC12CC1(C(=O)OC2)C=CC3=CC=CC=C3

DOS

IR

Vibrations