Geometry & MOs

Info

ID:	189172
PubChem CID:	77824794
Reduced:	N4O5C30H40 (1)
Stoich.:	A4B5C30D40 (1)
Weight, g/mol:	342.151034
ΔH_f, kcal/mol:	-222.88
Dipole, Da:	4.59
IP(EA), eV:	-9.37(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(3-chloro-2-fluorophenyl)-(3-methylpiperidin-3-yl)methoxy]ethyl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NCC1=CC=CC(=C1)CC(CC2C(=O)N(CCN2C(=O)OC(C)(C)C)CC3=CC=CC=C3)NC(=O)C

DOS

IR

Vibrations