Geometry & MOs

Info

ID:	221094
PubChem CID:	85256789
Reduced:	OC9H13 (2)
Stoich.:	AB9C13 (2)
Weight, g/mol:	274.204513
ΔH_f, kcal/mol:	-79.36
Dipole, Da:	2.45
IP(EA), eV:	-8.72(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(7-methyl-3,7-diazabicyclo[3.3.1]nonan-3-yl)-1-phenylpropan-1-ol

Drug info:

PubChemData

Smile

CC(=C)C1CC2(C(=O)C3(CCC24C1(C3)CCC4)OC)C

DOS

IR

Vibrations