Geometry & MOs

Info

ID:	397577
PubChem CID:	135030414
Reduced:	NO2C10H10 (2)
Stoich.:	AB2C10D10 (2)
Weight, g/mol:	226.059841
ΔH_f, kcal/mol:	-31.28
Dipole, Da:	1.3
IP(EA), eV:	-9.76(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyridin-4-yl N,N-diethylcarbamodithioate

Drug info:

PubChemData

Smile

CC(C)C1(C(=O)OC(=N1)C2=CC=CC=C2)C(C[N+](=O)[O-])C3=CC=CC=C3

DOS

IR

Vibrations