Geometry & MOs

Info

ID:	391147
PubChem CID:	135003146
Reduced:	O2F5H13C19 (1)
Stoich.:	A2B5C13D19 (1)
Weight, g/mol:	297.100108
ΔH_f, kcal/mol:	-239.41
Dipole, Da:	4.3
IP(EA), eV:	-10.06(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-methoxy-2-methyl-6-oxophenanthridine-9-carboxylate

Drug info:

PubChemData

Smile

CC(=O)C(C/C=C/C1=C(C(=C(C(=C1F)F)F)F)F)C(=O)C2=CC=CC=C2

DOS

IR

Vibrations