Geometry & MOs

Info

ID:	355301
PubChem CID:	127288258
Reduced:	O2N4C17H28 (1)
Stoich.:	A2B4C17D28 (1)
Weight, g/mol:	291.180758
ΔH_f, kcal/mol:	-45.28
Dipole, Da:	7.1
IP(EA), eV:	-8.69(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dimethyl-2-[[4-[(1-methyltetrazol-5-yl)methyl]piperazin-1-yl]methyl]-1,3-oxazole

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)CC(=O)N(C)CC3CC3)C

DOS

IR

Vibrations