Geometry & MOs

Info

ID:	55600
PubChem CID:	17395636
Reduced:	FO2N3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	287.084081
ΔH_f, kcal/mol:	-54.96
Dipole, Da:	7.37
IP(EA), eV:	-9.39(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-[[1-(4-methylphenyl)tetrazol-5-yl]sulfanylmethyl]-1,2-oxazole

Drug info:

PubChemData

Smile

CCN(CC1=CC(=CC=C1)F)C(=O)NC2=NOC(=C2)C

DOS

IR

Vibrations