Geometry & MOs

Info

ID:	235666
PubChem CID:	92710350
Reduced:	NOC16H25 (1)
Stoich.:	ABC16D25 (1)
Weight, g/mol:	247.193614
ΔH_f, kcal/mol:	-50.04
Dipole, Da:	3.24
IP(EA), eV:	-8.66(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-3-cyclohexyl-1-(4-methoxyphenyl)propan-1-amine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@H](CCC2CCCCC2)N

DOS

IR

Vibrations