Geometry & MOs

Info

ID:	352674
PubChem CID:	127283763
Reduced:	O2N4C19H32 (1)
Stoich.:	A2B4C19D32 (1)
Weight, g/mol:	305.185175
ΔH_f, kcal/mol:	-91.67
Dipole, Da:	0.74
IP(EA), eV:	-8.89(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]ethyl]-5-methyl-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)C(C)C(=O)NC3CCCCC3)C

DOS

IR

Vibrations