Geometry & MOs

Info

ID:	27686
PubChem CID:	823051
Reduced:	NO6C13H21 (1)
Stoich.:	AB6C13D21 (1)
Weight, g/mol:	339.131802
ΔH_f, kcal/mol:	-220.61
Dipole, Da:	4.12
IP(EA), eV:	-10.24(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1R,4R)-1-cyano-4-(furan-2-yl)-2,2,3,3-tetramethoxycyclobutane-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)[C@]1([C@H](C(C1(OC)OC)(OC)OC)C)C#N

DOS

IR

Vibrations