Geometry & MOs

Info

ID:	20195
PubChem CID:	582646
Reduced:	ClFSN2H16C17 (1)
Stoich.:	ABCD2E16F17 (1)
Weight, g/mol:	334.070676
ΔH_f, kcal/mol:	1.4
Dipole, Da:	2.97
IP(EA), eV:	-9.09(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-4-fluorophenyl)-N'-(1,2,3,4-tetrahydronaphthalen-1-yl)carbamimidothioic acid

Drug info:

PubChemData

Smile

C1CC(C2=CC=CC=C2C1)N=C(NC3=CC(=C(C=C3)F)Cl)S

DOS

IR

Vibrations