Geometry & MOs

Info

ID:	33409
PubChem CID:	7886316
Reduced:	FSO2N3H18C19 (1)
Stoich.:	ABC2D3E18F19 (1)
Weight, g/mol:	385.13726
ΔH_f, kcal/mol:	-69.68
Dipole, Da:	5.46
IP(EA), eV:	-8.94(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(2,4-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-ethyl-N-(4-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

CCN(C1=CC=C(C=C1)F)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C

DOS

IR

Vibrations