Geometry & MOs

Info

ID:	340303
PubChem CID:	127262314
Reduced:	ClO3C12H13 (1)
Stoich.:	AB3C12D13 (1)
Weight, g/mol:	182.13068
ΔH_f, kcal/mol:	-107.05
Dipole, Da:	3.4
IP(EA), eV:	-9.28(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylpent-3-enyl cyclobutanecarboxylate

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)OCOC2=CC(=CC=C2)Cl

DOS

IR

Vibrations