Geometry & MOs

Info

ID:	241074
PubChem CID:	93621543
Reduced:	SO3N4C13H20 (1)
Stoich.:	AB3C4D13E20 (1)
Weight, g/mol:	293.131031
ΔH_f, kcal/mol:	-104.22
Dipole, Da:	3.26
IP(EA), eV:	-8.95(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2S)-1-imidazol-1-yl-3,3-dimethylbutan-2-yl]-3-(1,3-thiazol-2-yl)urea

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N[C@@H]1CCCN(C1)C2=NC=CC=N2)S(=O)(=O)C

DOS

IR

Vibrations