Geometry & MOs

Info

ID:	385891
PubChem CID:	134980247
Reduced:	O3C26H26 (1)
Stoich.:	A3B26C26 (1)
Weight, g/mol:	260.141245
ΔH_f, kcal/mol:	-25.99
Dipole, Da:	1.86
IP(EA), eV:	-9.46(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(1S,2R)-2-phenylmethoxy-1-prop-2-enoxybut-3-enyl]oxirane

Drug info:

PubChemData

Smile

C=C[C@H](COCC1=CC=CC=C1)[C@H](C(=O)C2=CC=CC=C2)OCC3=CC=CC=C3

DOS

IR

Vibrations