Geometry & MOs

Info

ID:	344017
PubChem CID:	127267193
Reduced:	FSN2O4C15H23 (1)
Stoich.:	ABC2D4E15F23 (1)
Weight, g/mol:	344.159689
ΔH_f, kcal/mol:	-228.38
Dipole, Da:	4.16
IP(EA), eV:	-9.33(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(1,3-dihydroxypropan-2-yl)-2-methylbenzimidazol-5-yl]-3-(1-methylpyrazol-3-yl)urea

Drug info:

PubChemData

Smile

CCOCC(C(C)C)NC(=O)NC1=C(C(=CC=C1)F)S(=O)(=O)C

DOS

IR

Vibrations