Geometry & MOs

Info

ID:	32283
PubChem CID:	6436316
Reduced:	N2S2H25C29 (1)
Stoich.:	A2B2C25D29 (1)
Weight, g/mol:	174.064057
ΔH_f, kcal/mol:	120.74
Dipole, Da:	5.31
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.881122
Charge, e:	0

Chem-info

IUPAC name:

[(E)-acetyloxymethyldiazenyl]methyl acetate

Drug info:

PubChemData

Smile

CC/C(=C\C1=[N+](C2=C(S1)C=CC3=CC=CC=C32)C)/C=C\4/N(C5=C(S4)C=CC6=CC=CC=C65)C

DOS

IR

Vibrations