Geometry & MOs

Info

ID:	176070
PubChem CID:	75991591
Reduced:	ClN4O5H21C23 (1)
Stoich.:	AB4C5D21E23 (1)
Weight, g/mol:	377.094646
ΔH_f, kcal/mol:	-153.3
Dipole, Da:	7.01
IP(EA), eV:	-9.22(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[2-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1C2CC(=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Cl)NN2C(=O)C

DOS

IR

Vibrations