Geometry & MOs

Info

ID:	147117
PubChem CID:	53786770
Reduced:	N2O3C23H28 (1)
Stoich.:	A2B3C23D28 (1)
Weight, g/mol:	224.107539
ΔH_f, kcal/mol:	-99.73
Dipole, Da:	6.62
IP(EA), eV:	-8.95(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

5-ethoxyphenanthridin-5-ium

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CO[C@@H]2[C@H](C3=C(C=CN=C3)OC2(C)C)N4CCCCC4=O

DOS

IR

Vibrations