Geometry & MOs

Info

ID:	351182
PubChem CID:	127279740
Reduced:	S2N3O3C18H19 (1)
Stoich.:	A2B3C3D18E19 (1)
Weight, g/mol:	363.172896
ΔH_f, kcal/mol:	-80.96
Dipole, Da:	7.34
IP(EA), eV:	-9.0(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-3-(6-pyrrolidin-1-ylpyridazine-3-carbonyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CSCCN1C(=O)C2CSCN2C(=O)C3=CC(=O)NC4=CC=CC=C43

DOS

IR

Vibrations