Geometry & MOs

Info

ID:	145861
PubChem CID:	53604174
Reduced:	FN2O2C20H25 (1)
Stoich.:	AB2C2D20E25 (1)
Weight, g/mol:	299.141596
ΔH_f, kcal/mol:	-86.1
Dipole, Da:	3.2
IP(EA), eV:	-8.53(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-2-[1-(oxan-4-yl)tetrazol-5-yl]sulfanylacetamide

Drug info:

PubChemData

Smile

CN1CCC(CC1)N(CC2=CC=CC=C2F)C(=O)CCC3=CC=CO3

DOS

IR

Vibrations