Geometry & MOs

Info

ID:	403430
PubChem CID:	135060246
Reduced:	S2O3N4H22C25 (1)
Stoich.:	A2B3C4D22E25 (1)
Weight, g/mol:	363.11384
ΔH_f, kcal/mol:	11.81
Dipole, Da:	8.96
IP(EA), eV:	-8.71(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-butyl-4-chloro-2-pyridin-3-ylpyrido[2,3-b]indole-3-carbaldehyde

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)N1C2=CC=CC=C2C3=C(C(=NC=C31)C(=O)N(C)C4=CC=CC=C4)C5=CSC=C5

DOS

IR

Vibrations