Geometry & MOs

Info

ID:	73541
PubChem CID:	48418077
Reduced:	SO2N3C21H21 (1)
Stoich.:	AB2C3D21E21 (1)
Weight, g/mol:	379.166269
ΔH_f, kcal/mol:	-15.55
Dipole, Da:	3.79
IP(EA), eV:	-8.65(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(1-adamantyl)acetyl]-3-(5-chloro-3-methyl-1,2-oxazol-4-yl)propanehydrazide

Drug info:

PubChemData

Smile

C1CN(CCC1NC(=O)C2=CC3=C(C=C2)OCC3)C4=NC5=CC=CC=C5S4

DOS

IR

Vibrations