Geometry & MOs

Info

ID:	8798
PubChem CID:	81620
Reduced:	OC3H5 (2)
Stoich.:	AB3C5 (2)
Weight, g/mol:	114.06808
ΔH_f, kcal/mol:	-90.91
Dipole, Da:	1.93
IP(EA), eV:	-10.0(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

but-2-enyl acetate

Drug info:

PubChemData

Smile

CC=CCOC(=O)C

DOS

IR

Vibrations