Geometry & MOs

Info

ID:	433051
PubChem CID:	135173188
Reduced:	O2N7C19H21 (1)
Stoich.:	A2B7C19D21 (1)
Weight, g/mol:	195.1987
ΔH_f, kcal/mol:	47.14
Dipole, Da:	2.63
IP(EA), eV:	-8.37(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-3,5-dimethylbicyclo[3.3.1]nonan-1-amine

Drug info:

PubChemData

Smile

CC1=CN2C(=O)NN=C2N=C1N3CCC(CC3)OC4=CC5=C(C=C4)N(N=C5)C

DOS

IR

Vibrations