Geometry & MOs

Info

ID:	50050
PubChem CID:	11539026
Reduced:	N2O3C26H32 (1)
Stoich.:	A2B3C26D32 (1)
Weight, g/mol:	420.277678
ΔH_f, kcal/mol:	-114.84
Dipole, Da:	1.77
IP(EA), eV:	-9.18(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(dimethylamino)-4-(2-phenylethyl)cyclohexyl]-5-oxo-5-phenylpentanamide

Drug info:

PubChemData

Smile

CCC(CC)[C@@H]1C(=O)N[C@@H](C(=O)N1CC2=CC=CC=C2CO)C3CC4=CC=CC=C4C3

DOS

IR

Vibrations