Geometry & MOs

Info

ID:	220759
PubChem CID:	85238928
Reduced:	O2C13H22 (1)
Stoich.:	A2B13C22 (1)
Weight, g/mol:	200.141244
ΔH_f, kcal/mol:	-87.09
Dipole, Da:	2.4
IP(EA), eV:	-9.85(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-ethyl-1-(hydroxymethyl)cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC(=O)OC1CCCC2CCCCC1C2

DOS

IR

Vibrations