Geometry & MOs

Info

ID:	143147
PubChem CID:	53153886
Reduced:	ClFSO2N4H14C17 (1)
Stoich.:	ABCD2E4F14G17 (1)
Weight, g/mol:	350.174276
ΔH_f, kcal/mol:	-23.78
Dipole, Da:	1.95
IP(EA), eV:	-9.17(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3,5-dimethylpyrrol-1-yl]acetamide

Drug info:

PubChemData

Smile

CCC1=NOC(=N1)C2=CN=C(C=C2)SCC(=O)NC3=C(C=C(C=C3)F)Cl

DOS

IR

Vibrations