Geometry & MOs

Info

ID:	266192
PubChem CID:	103558753
Reduced:	OC5H8 (2)
Stoich.:	AB5C8 (2)
Weight, g/mol:	326.05176
ΔH_f, kcal/mol:	-72.68
Dipole, Da:	3.23
IP(EA), eV:	-9.82(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-2-methoxyphenyl)-3-(1-methoxycyclobutyl)propan-2-one

Drug info:

PubChemData

Smile

COC1(CCC1)CC(=O)CC=C

DOS

IR

Vibrations