Geometry & MOs

Info

ID:	172273
PubChem CID:	75487513
Reduced:	BNO4C21H34 (1)
Stoich.:	ABC4D21E34 (1)
Weight, g/mol:	196.14633
ΔH_f, kcal/mol:	-284.23
Dipole, Da:	3.32
IP(EA), eV:	-9.28(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(5S,7R)-3-methoxy-1-adamantyl]methanol

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)C(C)(C)CNC(=O)OC(C)(C)C

DOS

IR

Vibrations