Geometry & MOs

Info

ID:	340244
PubChem CID:	127262255
Reduced:	ClNS2C10H12 (1)
Stoich.:	ABC2D10E12 (1)
Weight, g/mol:	251.134385
ΔH_f, kcal/mol:	14.54
Dipole, Da:	4.06
IP(EA), eV:	-8.72(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-butan-2-yl N-phenyl-N-propan-2-ylcarbamothioate

Drug info:

PubChemData

Smile

CC(C)(C1=CC=C(C=C1)Cl)SC(=S)N

DOS

IR

Vibrations