Geometry & MOs

Info

ID:	291904
PubChem CID:	113635291
Reduced:	FON3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	239.2613
ΔH_f, kcal/mol:	-67.12
Dipole, Da:	3.17
IP(EA), eV:	-8.92(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cycloheptyl-3,3-dimethyl-N-propylbutan-2-amine

Drug info:

PubChemData

Smile

C[C@H]1CN(CCN1)CC2=C(C=C(C=C2)C(=O)N)F

DOS

IR

Vibrations