Geometry & MOs

Info

ID:	375330
PubChem CID:	131499986
Reduced:	BrNSO2H8C10 (1)
Stoich.:	ABCD2E8F10 (1)
Weight, g/mol:	181.085127
ΔH_f, kcal/mol:	-52.65
Dipole, Da:	6.17
IP(EA), eV:	-8.89(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-oxazol-5-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1=C2C=C(SC2=CC(=C1CC(=O)O)Br)N

DOS

IR

Vibrations