Geometry & MOs

Info

ID:	34528
PubChem CID:	7978629
Reduced:	SN2O6C20H24 (1)
Stoich.:	AB2C6D20E24 (1)
Weight, g/mol:	404.209993
ΔH_f, kcal/mol:	-194.32
Dipole, Da:	9.51
IP(EA), eV:	-8.92(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(2-phenylphenoxy)acetyl]adamantane-1-carbohydrazide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCC(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations