Geometry & MOs

Info

ID:	352666
PubChem CID:	127283755
Reduced:	ON2C10H17 (2)
Stoich.:	AB2C10D17 (2)
Weight, g/mol:	336.216141
ΔH_f, kcal/mol:	-96.3
Dipole, Da:	3.19
IP(EA), eV:	-8.64(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]-1-morpholin-4-ylpropan-1-one

Drug info:

PubChemData

Smile

CC1CCCC(C1C)NC(=O)CN2CCN(CC2)CC3=NC(=C(O3)C)C

DOS

IR

Vibrations