Geometry & MOs

Info

ID:	36480
PubChem CID:	8007365
Reduced:	OSN4C17H22 (1)
Stoich.:	ABC4D17E22 (1)
Weight, g/mol:	358.083268
ΔH_f, kcal/mol:	14.53
Dipole, Da:	3.73
IP(EA), eV:	-8.73(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C=CCSC1=NC2=CC=CC=C2N1CN3CCC[C@@H](C3)C(=O)N

DOS

IR

Vibrations