Geometry & MOs

Info

ID:	398838
PubChem CID:	135035665
Reduced:	O9H26C28 (1)
Stoich.:	A9B26C28 (1)
Weight, g/mol:	363.179421
ΔH_f, kcal/mol:	-302.73
Dipole, Da:	4.14
IP(EA), eV:	-9.96(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-tert-butyl 4-O-methyl (4S)-2-imino-3-[(4-methoxyphenyl)methyl]imidazolidine-1,4-dicarboxylate

Drug info:

PubChemData

Smile

CO[C@@H]1C(C([C@@H](C(O1)COC(=O)C2=CC=CC=C2)O)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations