Geometry & MOs

Info

ID:	47239
PubChem CID:	10530822
Reduced:	NO4C15H20 (2)
Stoich.:	AB4C15D20 (2)
Weight, g/mol:	556.257337
ΔH_f, kcal/mol:	-291.39
Dipole, Da:	3.57
IP(EA), eV:	-9.75(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-[(2S,3S,4R,5R)-3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-yl]-4-methylimidazole-1-carboxylate

Drug info:

PubChemData

Smile

CC#CC[C@@H](C(=O)OCC1=CC=CC=C1COC(=O)[C@H](CC#CC)NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations