Geometry & MOs

Info

ID:	299755
PubChem CID:	117689178
Reduced:	O4N5C30H39 (1)
Stoich.:	A4B5C30D39 (1)
Weight, g/mol:	334.936458
ΔH_f, kcal/mol:	-62.84
Dipole, Da:	5.81
IP(EA), eV:	-8.15(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4,6-trichlorophenyl)pyridine-4-carbohydrazonoyl chloride

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)NC2=NC(=NC3=C2C=C(C=C3)NC(=O)/C=C/CN(CCOC)CCOC)OCC4CC4

DOS

IR

Vibrations