Geometry & MOs

Info

ID:	42494
PubChem CID:	8149621
Reduced:	ON2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	386.153838
ΔH_f, kcal/mol:	-40.23
Dipole, Da:	7.88
IP(EA), eV:	-8.04(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

3-[[4-(benzenesulfonyl)-2-phenyl-1,3-oxazol-5-yl]amino]propyl-dimethylazanium

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=CC=C(C=C2)N[C@@H](C3=CC=CC=C3)C(=O)NC(=O)N

DOS

IR

Vibrations