Geometry & MOs

Info

ID:	68974
PubChem CID:	46514425
Reduced:	N2O2C13H13 (2)
Stoich.:	A2B2C13D13 (2)
Weight, g/mol:	419.091532
ΔH_f, kcal/mol:	-6.3
Dipole, Da:	5.67
IP(EA), eV:	-8.83(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N'-[2-[2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl]acetyl]benzohydrazide

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)C(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

DOS

IR

Vibrations