Geometry & MOs

Info

ID:	383200
PubChem CID:	134974781
Reduced:	ClINOH15C20 (1)
Stoich.:	ABCDE15F20 (1)
Weight, g/mol:	319.076392
ΔH_f, kcal/mol:	45.69
Dipole, Da:	2.4
IP(EA), eV:	-9.45(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-benzyl-2-chlorophenanthridin-6-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN(C2=C(C=C(C=C2)Cl)I)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations