Geometry & MOs

Info

ID:	61232
PubChem CID:	26707239
Reduced:	ClN3O4C21H24 (1)
Stoich.:	AB3C4D21E24 (1)
Weight, g/mol:	487.133255
ΔH_f, kcal/mol:	-150.97
Dipole, Da:	5.56
IP(EA), eV:	-9.46(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-2-(3,4-dimethoxyphenyl)-N-ethyl-4-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CCN(CC(=O)NCC1=CC=C(C=C1)Cl)C(=O)C2=CC(=CC=C2)NC(=O)OCC

DOS

IR

Vibrations