Geometry & MOs

Info

ID:	57746
PubChem CID:	24276937
Reduced:	ClSN3C12H16 (1)
Stoich.:	ABC3D12E16 (1)
Weight, g/mol:	256.080097
ΔH_f, kcal/mol:	37.88
Dipole, Da:	6.48
IP(EA), eV:	-8.63(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenyl)-2-(diethylamino)ethanethioamide

Drug info:

PubChemData

Smile

C1CN(CCN1)C(C2=CC=CC=C2Cl)C(=S)N

DOS

IR

Vibrations