Geometry & MOs

Info

ID:	158253
PubChem CID:	56463235
Reduced:	ClO2N4C21H23 (1)
Stoich.:	AB2C4D21E23 (1)
Weight, g/mol:	363.117211
ΔH_f, kcal/mol:	26.92
Dipole, Da:	2.81
IP(EA), eV:	-8.92(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenyl)-N-[2-[cyclopropyl(methyl)amino]propyl]-4-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=NN(C(=C1)C2=CC=CO2)C3=CC=C(C=C3)Cl)N(C)C4CC4

DOS

IR

Vibrations