Geometry & MOs

Info

ID:	34530
PubChem CID:	7978631
Reduced:	Cl2N3O3C18H21 (1)
Stoich.:	A2B3C3D18E21 (1)
Weight, g/mol:	356.209993
ΔH_f, kcal/mol:	-105.45
Dipole, Da:	4.28
IP(EA), eV:	-9.39(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[3-(4-methylphenoxy)propanoyl]adamantane-1-carbohydrazide

Drug info:

PubChemData

Smile

CCCCN1C(=C(C(=N1)C)C(=O)OCC(=O)NCC2=CC=C(C=C2)Cl)Cl

DOS

IR

Vibrations