Geometry & MOs

Info

ID:	58046
PubChem CID:	24423699
Reduced:	OSF2N2C10H12 (1)
Stoich.:	ABC2D2E10F12 (1)
Weight, g/mol:	395.110376
ΔH_f, kcal/mol:	-108.75
Dipole, Da:	5.29
IP(EA), eV:	-8.67(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-fluorophenyl)carbamothioylamino]-N-(4-methoxyphenyl)benzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)F)NC(=S)NCCCO

DOS

IR

Vibrations