Geometry & MOs

Info

ID:	403327
PubChem CID:	135059750
Reduced:	N2O2H16C19 (1)
Stoich.:	A2B2C16D19 (1)
Weight, g/mol:	660.00796
ΔH_f, kcal/mol:	-2.29
Dipole, Da:	1.21
IP(EA), eV:	-8.53(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 4-(2,3-dichlorophenyl)-3-iodo-2-phenyl-4H-pyrido[2,3-b]indole-1,9-dicarboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C2C3=CC=CC=C3NC2=N1)C4=CC(=C(C=C4)OC)O

DOS

IR

Vibrations