Geometry & MOs

Info

ID:	15083
PubChem CID:	429038
Reduced:	NO4C21H21 (1)
Stoich.:	AB4C21D21 (1)
Weight, g/mol:	351.147058
ΔH_f, kcal/mol:	-77.27
Dipole, Da:	4.24
IP(EA), eV:	-7.7(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,8,9-trimethoxy-5-methyl-9H-benzo[c]phenanthridin-3-ol

Drug info:

PubChemData

Smile

CN1C=C2C=C(C(C=C2C3=C1C4=CC(=C(C=C4C=C3)OC)O)OC)OC

DOS

IR

Vibrations