Geometry & MOs

Info

ID:	51292
PubChem CID:	12013937
Reduced:	NO5H21C22 (1)
Stoich.:	AB5C21D22 (1)
Weight, g/mol:	369.136493
ΔH_f, kcal/mol:	-115.14
Dipole, Da:	3.12
IP(EA), eV:	-8.8(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3S,5R)-2,5-diphenyl-1,2-oxazolidin-3-yl]chromen-4-one

Drug info:

PubChemData

Smile

CCOC(=O)[C@H]1[C@@H]([C@H](N(O1)C2=CC=CC=C2)C3=COC4=CC=CC=C4C3=O)C

DOS

IR

Vibrations