Geometry & MOs

Info

ID:	404516
PubChem CID:	135066578
Reduced:	O4C17H22 (1)
Stoich.:	A4B17C22 (1)
Weight, g/mol:	320.162374
ΔH_f, kcal/mol:	-162.69
Dipole, Da:	1.9
IP(EA), eV:	-9.56(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-tert-butyl 2-O-ethyl (1R,2R)-1-(4-methoxyphenyl)cyclopropane-1,2-dicarboxylate

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]1C[C@@]1(C2=CC=CC=C2)C(=O)OC(C)(C)C

DOS

IR

Vibrations