Geometry & MOs

Info

ID:	417494
PubChem CID:	135095555
Reduced:	N3C9H11 (2)
Stoich.:	A3B9C11 (2)
Weight, g/mol:	360.241293
ΔH_f, kcal/mol:	104.96
Dipole, Da:	3.52
IP(EA), eV:	-8.81(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-4-[[2,5-dimethyl-3-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]morpholine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1CCN(C(C1)CCC2=CC=CC=N2)CC3=NN4C=CC=NC4=N3

DOS

IR

Vibrations