Geometry & MOs

Info

ID:	64974
PubChem CID:	29204277
Reduced:	OSN2Cl3H11C14 (1)
Stoich.:	ABC2D3E11F14 (1)
Weight, g/mol:	428.020973
ΔH_f, kcal/mol:	2.76
Dipole, Da:	4.27
IP(EA), eV:	-9.16(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-nitro-2-pyrrolidin-1-yl-N'-(2,4,6-trichlorophenyl)benzohydrazide

Drug info:

PubChemData

Smile

C1CC2=C(C1)SC(=C2)C(=O)NNC3=C(C=C(C=C3Cl)Cl)Cl

DOS

IR

Vibrations