Geometry & MOs

Info

ID:	403418
PubChem CID:	135060189
Reduced:	ON2H14C18 (1)
Stoich.:	AB2C14D18 (1)
Weight, g/mol:	694.03432
ΔH_f, kcal/mol:	31.54
Dipole, Da:	2.08
IP(EA), eV:	-8.42(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 4-(2-chlorophenyl)-3-iodo-2-phenyl-7-(trifluoromethyl)-4H-pyrido[2,3-b]indole-1,9-dicarboxylate

Drug info:

PubChemData

Smile

CC1=C/C(=C/2\C=CC3=C(N2)NC4=CC=CC=C34)/C(=O)C=C1

DOS

IR

Vibrations