Geometry & MOs

Info

ID:	121073
PubChem CID:	50754998
Reduced:	ClO2N3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	338.13789
ΔH_f, kcal/mol:	-22.07
Dipole, Da:	5.53
IP(EA), eV:	-9.88(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-N-[[5-(2-phenylethyl)-1,2,4-oxadiazol-3-yl]methyl]-1,3-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC1=NC(=NO1)CNC(=O)C2=CC=CC=C2Cl

DOS

IR

Vibrations