Geometry & MOs

Info

ID:	324086
PubChem CID:	126676899
Reduced:	O3N4C20H22 (1)
Stoich.:	A3B4C20D22 (1)
Weight, g/mol:	368.109625
ΔH_f, kcal/mol:	-15.02
Dipole, Da:	6.47
IP(EA), eV:	-9.71(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[amino-[2-[4-(trifluoromethoxy)phenyl]hydrazinyl]methylidene]amino]methyl]benzoic acid

Drug info:

PubChemData

Smile

CCC1=NN=C(O1)C2CCCC(C2)NC(=O)C3=NOC(=C3)C4=CC=CC=C4

DOS

IR

Vibrations