Geometry & MOs

Info

ID:	227149
PubChem CID:	87560353
Reduced:	NS2C12H19 (1)
Stoich.:	AB2C12D19 (1)
Weight, g/mol:	302.11227
ΔH_f, kcal/mol:	12.59
Dipole, Da:	3.2
IP(EA), eV:	-8.81(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-benzyl carbamothioate;ethane;O-ethyl carbamothioate

Drug info:

PubChemData

Smile

CCCC.C1=CC=C(C=C1)CSC(=S)N

DOS

IR

Vibrations