Geometry & MOs

Info

ID:	233094
PubChem CID:	87692405
Reduced:	ON2C5H8 (1)
Stoich.:	AB2C5D8 (1)
Weight, g/mol:	273.972683
ΔH_f, kcal/mol:	-13.78
Dipole, Da:	3.19
IP(EA), eV:	-9.57(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(dithiocarboxyamino)methyl-phenylcarbamodithioic acid

Drug info:

PubChemData

Smile

CC1=NCC(N1)C=O

DOS

IR

Vibrations