Geometry & MOs

Info

ID:	340245
PubChem CID:	127262256
Reduced:	NOSC14H21 (1)
Stoich.:	ABCD14E21 (1)
Weight, g/mol:	231.165686
ΔH_f, kcal/mol:	-38.54
Dipole, Da:	3.91
IP(EA), eV:	-8.53(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C)OC(=S)N(C1=CC=CC=C1)C(C)C

DOS

IR

Vibrations