Geometry & MOs

Info

ID:	449815
PubChem CID:	135301780
Reduced:	NF3O3C8H12 (1)
Stoich.:	AB3C3D8E12 (1)
Weight, g/mol:	422.387229
ΔH_f, kcal/mol:	-294.69
Dipole, Da:	2.7
IP(EA), eV:	-10.23(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-1-[1-[2-(3-methyldecan-3-ylamino)acetyl]piperidin-4-yl]hexan-1-one

Drug info:

PubChemData

Smile

CC(C)([C@@H](C=O)NC(=O)OC)C(F)(F)F

DOS

IR

Vibrations