Geometry & MOs

Info

ID:	359872
PubChem CID:	127299916
Reduced:	ON2C6H10 (3)
Stoich.:	AB2C6D10 (3)
Weight, g/mol:	390.172562
ΔH_f, kcal/mol:	-86.31
Dipole, Da:	4.16
IP(EA), eV:	-8.97(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)CN2CCN(CC2)C(C)C(=O)N3CCOCC3)C

DOS

IR

Vibrations