Geometry & MOs

Info

ID:	315132
PubChem CID:	126624568
Reduced:	O2N4H18C23 (1)
Stoich.:	A2B4C18D23 (1)
Weight, g/mol:	257.199094
ΔH_f, kcal/mol:	63.54
Dipole, Da:	4.06
IP(EA), eV:	-8.96(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methylpropan-2-yl)oxy-(4-methyl-4-prop-2-enoxypiperidin-1-yl)methanol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1OC2=NC(=NC=C2)NC3=CC=C(C=C3)C#N)C)C4=CC=CO4

DOS

IR

Vibrations