Geometry & MOs

Info

ID:	382945
PubChem CID:	134974391
Reduced:	NOH19C26 (1)
Stoich.:	ABC19D26 (1)
Weight, g/mol:	319.076392
ΔH_f, kcal/mol:	53.65
Dipole, Da:	3.29
IP(EA), eV:	-8.72(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-benzyl-7-chlorophenanthridin-6-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C(C2=O)C=CC(=C4)C5=CC=CC=C5

DOS

IR

Vibrations