Geometry & MOs

Info

ID:	20577
PubChem CID:	584669
Reduced:	N2F3O3C17H19 (1)
Stoich.:	A2B3C3D17E19 (1)
Weight, g/mol:	356.134777
ΔH_f, kcal/mol:	-232.43
Dipole, Da:	5.0
IP(EA), eV:	-9.35(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-N'-[2-(2,2,2-trifluoroacetyl)cyclohepten-1-yl]benzohydrazide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)NNC2=C(CCCCC2)C(=O)C(F)(F)F

DOS

IR

Vibrations