Geometry & MOs

Info

ID:	274851
PubChem CID:	103812013
Reduced:	ON2C12H22 (1)
Stoich.:	AB2C12D22 (1)
Weight, g/mol:	306.176585
ΔH_f, kcal/mol:	-50.76
Dipole, Da:	2.66
IP(EA), eV:	-8.99(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(2-methylsulfanylcyclohexyl)-4-phenylbutanamide

Drug info:

PubChemData

Smile

C1CCN[C@H](C1)C(=O)NCCCC2CC2

DOS

IR

Vibrations