Geometry & MOs

Info

ID:	128318
PubChem CID:	51038843
Reduced:	FO3N6C21H23 (1)
Stoich.:	AB3C6D21E23 (1)
Weight, g/mol:	181.146664
ΔH_f, kcal/mol:	-73.07
Dipole, Da:	4.51
IP(EA), eV:	-8.68(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-amino-2-methyladamantan-2-ol

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)CCC2=NC3=C(C(=CC(=C3)F)NCCO)C4=NC(=NN24)N)OC

DOS

IR

Vibrations