Geometry & MOs

Info

ID:	393077
PubChem CID:	135019296
Reduced:	N7H19C25 (1)
Stoich.:	A7B19C25 (1)
Weight, g/mol:	297.136493
ΔH_f, kcal/mol:	223.59
Dipole, Da:	4.41
IP(EA), eV:	-8.72(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4R)-1-oxido-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyrrol-1-ium

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN2C=C(N=N2)C3=CC=C(C=C3)C4=CN(N=N4)CC5=CC=C(C=C5)C#N

DOS

IR

Vibrations