Geometry & MOs

Info

ID:	266784
PubChem CID:	103579412
Reduced:	N2O6C13H16 (1)
Stoich.:	A2B6C13D16 (1)
Weight, g/mol:	267.110673
ΔH_f, kcal/mol:	-145.35
Dipole, Da:	7.16
IP(EA), eV:	-10.05(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,6-dihydroxyphenyl)-(3,4-dimethoxypyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

COC1CN(CC1OC)C(=O)C2=C(C(=CC=C2)[N+](=O)[O-])O

DOS

IR

Vibrations