Geometry & MOs

Info

ID:	342677
PubChem CID:	127265837
Reduced:	ClSN2H7C10 (1)
Stoich.:	ABC2D7E10 (1)
Weight, g/mol:	300.108562
ΔH_f, kcal/mol:	76.67
Dipole, Da:	1.28
IP(EA), eV:	-9.25(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-acetylphenyl)-3-[1-(trifluoromethyl)cyclobutyl]urea

Drug info:

PubChemData

Smile

C1=CN=CN=C1C=CC2=CC(=CS2)Cl

DOS

IR

Vibrations