Geometry & MOs

Info

ID:	138363
PubChem CID:	52355163
Reduced:	NO3C11H15 (2)
Stoich.:	AB3C11D15 (2)
Weight, g/mol:	362.152495
ΔH_f, kcal/mol:	-239.72
Dipole, Da:	5.26
IP(EA), eV:	-9.08(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(dimethylamino)phenyl]-2-[1-[[(2S)-oxolan-2-yl]methyl]tetrazol-5-yl]sulfanylacetamide

Drug info:

PubChemData

Smile

C[C@H]1CCC[C@@H]([C@@H]1C)NC(=O)COC(=O)/C=C/C2=CC(=C(C=C2)OCC(=O)N)OC

DOS

IR

Vibrations