Geometry & MOs

Info

ID:	220754
PubChem CID:	85238732
Reduced:	OC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	174.06808
ΔH_f, kcal/mol:	-104.99
Dipole, Da:	2.05
IP(EA), eV:	-9.83(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(oxiran-2-yl)-1-phenylprop-2-en-1-one

Drug info:

PubChemData

Smile

CC1CC=C(C1(C(C)C)O)CO

DOS

IR

Vibrations