Geometry & MOs

Info

ID:	305658
PubChem CID:	124964061
Reduced:	ON6C17H20 (1)
Stoich.:	AB6C17D20 (1)
Weight, g/mol:	338.149124
ΔH_f, kcal/mol:	76.14
Dipole, Da:	2.51
IP(EA), eV:	-9.34(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-(3-pyridin-3-yl-1H-pyrazol-5-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C2=CN=CC(=N2)[C@H]3CCCN3CC4=CN=CN4

DOS

IR

Vibrations