Geometry & MOs

Info

ID:	421709
PubChem CID:	135116456
Reduced:	N2O2C19H28 (1)
Stoich.:	A2B2C19D28 (1)
Weight, g/mol:	277.19026
ΔH_f, kcal/mol:	-80.79
Dipole, Da:	6.22
IP(EA), eV:	-8.53(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[4-[ethyl(methyl)amino]pyrimidin-2-yl]piperidin-3-yl]acetamide

Drug info:

PubChemData

Smile

CNC(=O)C1=CC=C(C=C1)CN2CCC[C@]3(C2)CCC[C@H]3OC

DOS

IR

Vibrations