Geometry & MOs

Info

ID:	142051
PubChem CID:	52972756
Reduced:	O3N4C17H18 (1)
Stoich.:	A3B4C17D18 (1)
Weight, g/mol:	381.18009
ΔH_f, kcal/mol:	-13.53
Dipole, Da:	1.76
IP(EA), eV:	-9.41(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-oxo-3-[2-(5-phenylpyrazolidine-3-carbonyl)hydrazinyl]propyl]benzamide

Drug info:

PubChemData

Smile

C1C(NNC1C(=O)NNC(=O)/C=C/C2=CC=CO2)C3=CC=CC=C3

DOS

IR

Vibrations