Geometry & MOs

Info

ID:	217850
PubChem CID:	85088489
Reduced:	N2O5H22C23 (1)
Stoich.:	A2B5C22D23 (1)
Weight, g/mol:	406.164105
ΔH_f, kcal/mol:	-70.61
Dipole, Da:	5.67
IP(EA), eV:	-9.75(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-(benzhydrylamino)-2-oxoethoxy]carbonylpyrrolidin-1-yl]-2-diazonioethenolate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(C(=O)OCC2=CC=CC=C2)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

DOS

IR

Vibrations