Geometry & MOs

Info

ID:	14107
PubChem CID:	404604
Reduced:	NO4H19C26 (1)
Stoich.:	AB4C19D26 (1)
Weight, g/mol:	409.131408
ΔH_f, kcal/mol:	-55.22
Dipole, Da:	1.91
IP(EA), eV:	-8.58(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-benzyl-2-hydroxy-11-methylidene-6-oxobenzo[b]carbazole-1-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=C(C=CC2=C1C3=C(N2CC4=CC=CC=C4)C(=O)C5=CC=CC=C5C3=C)O

DOS

IR

Vibrations