Geometry & MOs

Info

ID:	225373
PubChem CID:	85756525
Reduced:	SN4O4H12C15 (1)
Stoich.:	AB4C4D12E15 (1)
Weight, g/mol:	219.046633
ΔH_f, kcal/mol:	58.06
Dipole, Da:	4.13
IP(EA), eV:	-9.06(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-6-(1,3-thiazol-2-ylhydrazinylidene)cyclohexa-2,4-dien-1-one

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)[N+](=O)[O-])C2C(NC(=S)N2)C3=CC(=CC=C3)[N+](=O)[O-]

DOS

IR

Vibrations