Geometry & MOs

Info

ID:	304549
PubChem CID:	124756257
Reduced:	OSN2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	263.138225
ΔH_f, kcal/mol:	-10.04
Dipole, Da:	2.76
IP(EA), eV:	-8.97(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-N-[[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-pyrimidin-4-ylethanamine

Drug info:

PubChemData

Smile

CC(C)[C@H]1C=CCN1CC(=O)NCC2=CC=CS2

DOS

IR

Vibrations