Geometry & MOs

Info

ID:	336154
PubChem CID:	127255161
Reduced:	O3N5C27H37 (1)
Stoich.:	A3B5C27D37 (1)
Weight, g/mol:	492.179755
ΔH_f, kcal/mol:	-67.7
Dipole, Da:	3.57
IP(EA), eV:	-8.59(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(8-methoxy-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-2-oxoethyl]-6aH-isoindolo[2,3-a]quinazoline-5,11-dione

Drug info:

PubChemData

Smile

CC(C)C(C1=CC(=C(C=C1)OC)OC)NC(=O)NCC2(CCCCC2)CC3=NN=C4N3C=CC=C4

DOS

IR

Vibrations