Geometry & MOs

Info

ID:	273673
PubChem CID:	103771662
Reduced:	BrNSO2H14C15 (1)
Stoich.:	ABCD2E14F15 (1)
Weight, g/mol:	278.072513
ΔH_f, kcal/mol:	-19.46
Dipole, Da:	2.79
IP(EA), eV:	-9.34(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-N-(2-hydroxy-2-thiophen-3-ylethyl)-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)/C=C/C(=O)NCC(C2=CSC=C2)O)Br

DOS

IR

Vibrations