Geometry & MOs

Info

ID:	168569
PubChem CID:	74989516
Reduced:	PN3O11C23H34 (1)
Stoich.:	AB3C11D23E34 (1)
Weight, g/mol:	313.061804
ΔH_f, kcal/mol:	-499.13
Dipole, Da:	6.35
IP(EA), eV:	-8.98(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chlorophenyl) N-(2-cyanophenyl)-2-oxopropanehydrazonate

Drug info:

PubChemData

Smile

CC1C(C(C(C(O1)OP(=O)(NC(CC(C)C)C(=O)NC(CC2=CN(C3=CC=CC=C32)O)C(=O)O)O)O)O)O

DOS

IR

Vibrations