Geometry & MOs

Info

ID:	126818
PubChem CID:	50980065
Reduced:	SN4C21H32 (1)
Stoich.:	AB4C21D32 (1)
Weight, g/mol:	290.210661
ΔH_f, kcal/mol:	33.79
Dipole, Da:	4.34
IP(EA), eV:	-8.75(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethoxy-2-(4-piperidin-1-ylpiperidin-1-yl)pyrimidine

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)CN2CCC(CC2)CC3=NN=C(N3C)SC

DOS

IR

Vibrations