Geometry & MOs

Info

ID:	15130
PubChem CID:	430347
Reduced:	NO2H13C15 (1)
Stoich.:	AB2C13D15 (1)
Weight, g/mol:	239.094629
ΔH_f, kcal/mol:	-7.38
Dipole, Da:	3.83
IP(EA), eV:	-7.65(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-10aH-[1,3]dioxolo[4,5-j]phenanthridine

Drug info:

PubChemData

Smile

CN1C=C2C=C3C(C=C2C4=CC=CC=C41)OCO3

DOS

IR

Vibrations