Geometry & MOs

Info

ID:	180988
PubChem CID:	76713791
Reduced:	N2O3C32H48 (1)
Stoich.:	A2B3C32D48 (1)
Weight, g/mol:	510.345758
ΔH_f, kcal/mol:	-135.85
Dipole, Da:	7.55
IP(EA), eV:	-8.72(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[1-hydroxy-5-methoxy-1-[2-(2-methylphenoxy)phenyl]pentyl]piperidin-1-yl]-3,3-dimethyl-4-(methylamino)butan-1-one

Drug info:

PubChemData

Smile

CC(C)CC(CC(=O)N1CCCC(C1)C(CCCCOC)(C2=CC=CC=C2C3=CC=CC=C3)O)CNC

DOS

IR

Vibrations