Geometry & MOs

Info

ID:	394129
PubChem CID:	135022392
Reduced:	N3O7C15H15 (1)
Stoich.:	A3B7C15D15 (1)
Weight, g/mol:	367.105587
ΔH_f, kcal/mol:	-194.55
Dipole, Da:	4.29
IP(EA), eV:	-10.01(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3'S,4'S,5'R)-6'-hydroxy-5'-methyl-3'-nitro-4'-phenylspiro[indene-2,2'-oxane]-1,3-dione

Drug info:

PubChemData

Smile

C[C@@H]1[C@H]([C@@H](C2(C(=O)NC(=O)NC2=O)O[C@H]1O)[N+](=O)[O-])C3=CC=CC=C3

DOS

IR

Vibrations