Geometry & MOs

Info

ID:	40345
PubChem CID:	8143970
Reduced:	ON2C8H11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	403.014203
ΔH_f, kcal/mol:	-49.08
Dipole, Da:	8.58
IP(EA), eV:	-9.04(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-(4-chloro-2-phenyl-1,3-thiazol-5-yl)methylideneamino]-2,4-dinitroaniline

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CN(C)CC1=NC(=O)C2=CC=CC=C2N1

DOS

IR

Vibrations