Geometry & MOs

Info

ID:	392452
PubChem CID:	135016500
Reduced:	N3O3H11C14 (1)
Stoich.:	A3B3C11D14 (1)
Weight, g/mol:	262.141638
ΔH_f, kcal/mol:	9.97
Dipole, Da:	7.32
IP(EA), eV:	-9.36(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[(4R,5R)-5-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]ethane-1,2-diol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2NC3=C(C=CC(=C3)[N+](=O)[O-])C(=O)N2

DOS

IR

Vibrations