Geometry & MOs

Info

ID:	35433
PubChem CID:	7979861
Reduced:	N2O5C20H24 (1)
Stoich.:	A2B5C20D24 (1)
Weight, g/mol:	378.134635
ΔH_f, kcal/mol:	-150.4
Dipole, Da:	2.38
IP(EA), eV:	-9.03(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-adamantylmethyl)-2-(4-chloro-2-nitrophenoxy)acetamide

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC(=C2)OC)OC

DOS

IR

Vibrations