Geometry & MOs

Info

ID:	7560
PubChem CID:	73376
Reduced:	NO2S2C7H13 (1)
Stoich.:	AB2C2D7E13 (1)
Weight, g/mol:	207.038771
ΔH_f, kcal/mol:	-87.02
Dipole, Da:	7.7
IP(EA), eV:	-9.13(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(diethylcarbamothioylsulfanyl)acetic acid

Drug info:

PubChemData

Smile

CCN(CC)C(=S)SCC(=O)O

DOS

IR

Vibrations