Geometry & MOs

Info

ID:	24934
PubChem CID:	614986
Reduced:	NOC18H25 (1)
Stoich.:	ABC18D25 (1)
Weight, g/mol:	271.193614
ΔH_f, kcal/mol:	-46.08
Dipole, Da:	0.94
IP(EA), eV:	-8.58(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1-adamantyl)phenoxy]ethanamine

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)OCCN

DOS

IR

Vibrations