Geometry & MOs

Info

ID:	197279
PubChem CID:	78946597
Reduced:	FON2C15H23 (1)
Stoich.:	ABC2D15E23 (1)
Weight, g/mol:	266.154976
ΔH_f, kcal/mol:	-88.54
Dipole, Da:	1.48
IP(EA), eV:	-8.25(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[3-chloro-4-(4-methylazepan-1-yl)phenyl]ethanamine

Drug info:

PubChemData

Smile

CCN1CCN(CC1C)C2=C(C=C(C=C2)F)[C@H](C)O

DOS

IR

Vibrations