Geometry & MOs

Info

ID:	304465
PubChem CID:	124752942
Reduced:	O2N5C16H19 (1)
Stoich.:	A2B5C16D19 (1)
Weight, g/mol:	322.146347
ΔH_f, kcal/mol:	-2.85
Dipole, Da:	4.55
IP(EA), eV:	-9.2(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[[5-[(2S)-oxolan-2-yl]-1,2,4-oxadiazol-3-yl]methyl]-1-(2-propan-2-yl-1,3-thiazol-4-yl)methanamine

Drug info:

PubChemData

Smile

CN1CCN(C[C@@H]1C(=O)O)CC2=CN=C(N=C2)C3=CC=CC=N3

DOS

IR

Vibrations