Geometry & MOs

Info

ID:	264867
PubChem CID:	103498893
Reduced:	NO4C15H21 (1)
Stoich.:	AB4C15D21 (1)
Weight, g/mol:	211.193614
ΔH_f, kcal/mol:	-171.14
Dipole, Da:	4.75
IP(EA), eV:	-9.32(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-2-one

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1OC)NC(=O)C(C)C(C)C(=O)O

DOS

IR

Vibrations