Geometry & MOs

Info

ID:	147988
PubChem CID:	53787650
Reduced:	N2S3H12C16 (1)
Stoich.:	A2B3C12D16 (1)
Weight, g/mol:	448.178693
ΔH_f, kcal/mol:	138.13
Dipole, Da:	4.22
IP(EA), eV:	-9.05(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(tritylamino)-7,8-dihydro-[1,3]dioxolo[4,5-g]quinolin-6-one

Drug info:

PubChemData

Smile

C1C(N=NC(=C1C2=CC=CS2)C3=CC=CS3)C4=CC=CS4

DOS

IR

Vibrations