Geometry & MOs

Info

ID:	45486
PubChem CID:	10514101
Reduced:	O3C14H22 (1)
Stoich.:	A3B14C22 (1)
Weight, g/mol:	238.102751
ΔH_f, kcal/mol:	-125.58
Dipole, Da:	2.67
IP(EA), eV:	-8.54(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-(benzylsulfanylmethyl)-2,2-dimethyl-1,3-dioxolane

Drug info:

PubChemData

Smile

CC(C)CCC1=C(C=C(C=C1OC)OC)OC

DOS

IR

Vibrations