Geometry & MOs

Info

ID:	322239
PubChem CID:	126669490
Reduced:	ClNO4C17H24 (1)
Stoich.:	ABC4D17E24 (1)
Weight, g/mol:	466.259835
ΔH_f, kcal/mol:	-195.85
Dipole, Da:	3.95
IP(EA), eV:	-9.35(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[(5S)-5-[(4-chlorophenyl)methyl]-2-(2-methoxypropan-2-yl)morpholin-4-yl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC(OCC1CC2=CC=C(C=C2)Cl)CO

DOS

IR

Vibrations