Geometry & MOs

Info

ID:	35554
PubChem CID:	7980023
Reduced:	ClON2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	388.178693
ΔH_f, kcal/mol:	-10.11
Dipole, Da:	1.81
IP(EA), eV:	-9.82(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-N'-(4-phenoxybenzoyl)benzohydrazide

Drug info:

PubChemData

Smile

C[C@@H]1CCCC[C@@H]1NC(=O)/C(=C/C2=CC(=CC=C2)Cl)/C#N

DOS

IR

Vibrations