Geometry & MOs

Info

ID:	322240
PubChem CID:	126669492
Reduced:	ClN2O4C25H39 (1)
Stoich.:	AB2C4D25E39 (1)
Weight, g/mol:	346.246772
ΔH_f, kcal/mol:	-210.44
Dipole, Da:	5.95
IP(EA), eV:	-8.73(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]piperidin-4-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC(CC1)N2CC(OC[C@@H]2CC3=CC=C(C=C3)Cl)C(C)(C)OC

DOS

IR

Vibrations