Geometry & MOs

Info

ID:	197207
PubChem CID:	78938240
Reduced:	BrON2C14H23 (1)
Stoich.:	ABC2D14E23 (1)
Weight, g/mol:	267.138992
ΔH_f, kcal/mol:	-32.59
Dipole, Da:	4.36
IP(EA), eV:	-8.8(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(3-chloro-4-cycloheptyloxyphenyl)ethanamine

Drug info:

PubChemData

Smile

CCN(CC)CCOC1=C(C=C(C=C1)[C@H](C)N)Br

DOS

IR

Vibrations