Geometry & MOs

Info

ID:	397018
PubChem CID:	135029606
Reduced:	NOC11H12 (2)
Stoich.:	ABC11D12 (2)
Weight, g/mol:	362.163043
ΔH_f, kcal/mol:	-48.48
Dipole, Da:	3.0
IP(EA), eV:	-8.9(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyclohexyl-6-hydroxy-8-methoxyindolo[2,1-b]quinazolin-12-one

Drug info:

PubChemData

Smile

CCCCCCC1(C2=C(C=CC(=C2)C)N3C1=NC4=CC=CC=C4C3=O)O

DOS

IR

Vibrations