Geometry & MOs

Info

ID:	266191
PubChem CID:	103558752
Reduced:	OC9H12 (2)
Stoich.:	AB9C12 (2)
Weight, g/mol:	168.11503
ΔH_f, kcal/mol:	-80.79
Dipole, Da:	0.86
IP(EA), eV:	-9.2(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methoxycyclobutyl)pent-4-en-2-one

Drug info:

PubChemData

Smile

COC1(CCC1)CC(=O)CC2CCCC3=CC=CC=C23

DOS

IR

Vibrations