Geometry & MOs

Info

ID:	313024
PubChem CID:	126610788
Reduced:	N2O3C16H18 (1)
Stoich.:	A2B3C16D18 (1)
Weight, g/mol:	191.043856
ΔH_f, kcal/mol:	-40.94
Dipole, Da:	1.71
IP(EA), eV:	-8.4(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(dithiolan-3-ylmethyl)-N-methylacetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C)OC)N=NC2=CC(=C(C=C2)OC)O

DOS

IR

Vibrations