Geometry & MOs

Info

ID:	244359
PubChem CID:	99344244
Reduced:	SO2N4C19H20 (1)
Stoich.:	AB2C4D19E20 (1)
Weight, g/mol:	405.172228
ΔH_f, kcal/mol:	1.27
Dipole, Da:	1.47
IP(EA), eV:	-8.77(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-methyl-N-[4-oxo-4-[2-(1,3-thiazol-4-ylmethoxy)anilino]butyl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=C(S1)C)C(=O)CCC(=O)NC2=CN(N=C2)CC3=CC=NC=C3

DOS

IR

Vibrations