Geometry & MOs

Info

ID:	53816
PubChem CID:	14718041
Reduced:	C13H14 (1)
Stoich.:	A13B14 (1)
Weight, g/mol:	174.082684
ΔH_f, kcal/mol:	19.37
Dipole, Da:	1.02
IP(EA), eV:	-8.54(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(diethylcarbamothioyl)acetamide

Drug info:

PubChemData

Smile

CCC1=C(C2=CC=CC=C2C=C1)C

DOS

IR

Vibrations