Geometry & MOs

Info

ID:	85640
PubChem CID:	49877827
Reduced:	O2N7C18H23 (1)
Stoich.:	A2B7C18D23 (1)
Weight, g/mol:	403.287515
ΔH_f, kcal/mol:	29.12
Dipole, Da:	7.1
IP(EA), eV:	-8.77(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-adamantyl)-N-[4-(1-adamantyl)phenyl]acetamide

Drug info:

PubChemData

Smile

C1CCN(C1)C2=NC(=NC(=N2)NN/C=C/3\C=CC=CC3=O)N4CCOCC4

DOS

IR

Vibrations