Geometry & MOs

Info

ID:	48521
PubChem CID:	11077254
Reduced:	N2O3C16H26 (1)
Stoich.:	A2B3C16D26 (1)
Weight, g/mol:	297.136493
ΔH_f, kcal/mol:	-107.69
Dipole, Da:	1.82
IP(EA), eV:	-9.48(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,4S,5S)-5-(hydroxymethyl)-4-methyl-2-phenyl-1,2-oxazolidin-3-yl]-phenylmethanone

Drug info:

PubChemData

Smile

C[C@H](C=C)[C@H]([C@@H]([C@@H]([C@@H](CO)O)O)NCC1=CC=CC=C1)N

DOS

IR

Vibrations