Geometry & MOs

Info

ID:	306073
PubChem CID:	125001561
Reduced:	ON5C16H23 (1)
Stoich.:	AB5C16D23 (1)
Weight, g/mol:	466.269239
ΔH_f, kcal/mol:	3.07
Dipole, Da:	5.01
IP(EA), eV:	-9.12(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-4-(4-methoxyphenyl)-N,N-dimethyl-1-(6-methyl-2-piperidin-1-ylpyrimidine-4-carbonyl)piperazine-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC=CN1CCC(=O)N2CCC[C@@H](C2)C3=CC=NN3

DOS

IR

Vibrations