Geometry & MOs

Info

ID:	430033
PubChem CID:	135170090
Reduced:	OSN2C16H18 (1)
Stoich.:	ABC2D16E18 (1)
Weight, g/mol:	366.148061
ΔH_f, kcal/mol:	-2.33
Dipole, Da:	3.42
IP(EA), eV:	-8.76(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(E)-(3,3-dimethyl-1H-indol-2-ylidene)methyl]imino-1,10-phenanthrolin-5-one

Drug info:

PubChemData

Smile

CCSC1=CC=C(C=C1)CNC(=O)C2=CN=C(C=C2)C

DOS

IR

Vibrations