Geometry & MOs

Info

ID:	155892
PubChem CID:	56368163
Reduced:	N2O3C25H28 (1)
Stoich.:	A2B3C25D28 (1)
Weight, g/mol:	409.149384
ΔH_f, kcal/mol:	-61.38
Dipole, Da:	7.34
IP(EA), eV:	-8.72(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-tert-butyl-1,3-thiazol-4-yl)methyl]-1-methyl-1-[1-(4-methylsulfonylphenyl)ethyl]urea

Drug info:

PubChemData

Smile

CC(C1=C(C=C(C=C1)OC)OC)NC(=O)N(C)CC2=CC=CC=C2C3=CC=CC=C3

DOS

IR

Vibrations