Geometry & MOs

Info

ID:	31957
PubChem CID:	3725303
Reduced:	SN3O3C15H19 (1)
Stoich.:	AB3C3D15E19 (1)
Weight, g/mol:	285.24565
ΔH_f, kcal/mol:	-98.87
Dipole, Da:	5.33
IP(EA), eV:	-9.64(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-adamantyl)adamantan-2-amine

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)C3=NNC4=NC(=O)C(S4)CC(=O)O

DOS

IR

Vibrations