Geometry & MOs

Info

ID:	409006
PubChem CID:	135081779
Reduced:	NO4C23H34 (1)
Stoich.:	AB4C23D34 (1)
Weight, g/mol:	218.160656
ΔH_f, kcal/mol:	-199.84
Dipole, Da:	2.26
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.754398
Charge, e:	0

Chem-info

IUPAC name:

lithium;3,4-dihydro-2H-pyran-6-yl-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]azanide

Drug info:

PubChemData

Smile

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[CH]NC(=O)OC(C)(C)C)C(C)(C)C2=CC=CC=C2

DOS

IR

Vibrations